SCHEMBL10199538

SCHEMBL10199538

CC(C)(C)OC(=O)N1CCCOC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
RECQL P46063 1/20 0.49
HPGD P15428 2/20 0.47
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
EPHX1 P07099 1/20 0.42
NR1H2 P55055 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.40
PREP P48147 2/20 0.40
CTSK P43235 1/20 0.39
TSHR P16473 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5190250 0.95 USP2 (0.59) USP2SMN1; SMN2RECQLHPGDMEN1
SCHEMBL779445 0.89 SMN1; SMN2 (0.76) USP2SMN1; SMN2RECQLHPGDEPHX1
SCHEMBL12629406 0.89 USP2 (0.76) USP2SMN1; SMN2RECQLHPGDMEN1
SCHEMBL2920417 0.86 SMN1; SMN2 (0.83) USP2SMN1; SMN2RECQLHPGDMEN1
SCHEMBL28210710 0.82 USP2 (0.71) USP2SMN1; SMN2RECQLHPGDMEN1
SCHEMBL24693074 0.82 SMN1; SMN2 (0.60) USP2SMN1; SMN2RECQLHPGDMEN1
SCHEMBL18084793 0.81 SMN1; SMN2 (0.80) USP2SMN1; SMN2RECQLHPGDMEN1
SCHEMBL27982542 0.81 USP2 (0.62) USP2SMN1; SMN2RECQLHPGDMEN1
Fluoride SCHEMBL28063281 0.79 HPGD (0.69) USP2SMN1; SMN2RECQLHPGDMEN1
SCHEMBL861278 0.78 USP2 (0.64) USP2SMN1; SMN2RECQLHPGDMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230056447-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-02-23 US disclosed
US-20210403459-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. 2021-12-30 US disclosed
US-11046698-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2021-06-29 US disclosed
US-11008309-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof Karyopharm Therapeutics Inc. (US) 2021-05-18 US disclosed
US-10577373-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-03-03 US disclosed
US-10570145-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-02-25 US disclosed
US-10562907-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-02-18 US disclosed
US-10562906-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-02-18 US disclosed
US-10399963-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof Karyopharm Therapeutics Inc. (US) 2019-09-03 US disclosed
US-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-22 US disclosed
US-20190031664-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-01-31 US disclosed
US-20180186801-A1 SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2018-07-05 US disclosed
US-9957271-B2 Substituted bicyclic aza-heterocycles and analogues as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2018-05-01 US disclosed
EP-2768509-B1 SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC (US) 2017-03-22 EP disclosed
US-9556201-B2 Bicyclic pyridines and analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-01-31 US disclosed
US-20150238506-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2015-08-27 US disclosed
US-9079907-B2 Fused heterocyclic compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-07-14 US disclosed
US-20120165312-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SHIRAI JUNYA (JP) 2012-06-28 US disclosed
US-8158617-B2 Fused heterocyclic compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-04-17 US disclosed
US-20090131402-A1 Fused heterocyclic compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED 2009-05-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (15 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120165312-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF HTR2C, HTR3C, HTR3B USP2 3142/4885SMN1; SMN2 3017/4885RECQL 4484/4885
US-20090131402-A1 Fused heterocyclic compound and use thereof HTR2C, HTR3C, HTR3B USP2 3142/4885SMN1; SMN2 3017/4885RECQL 4484/4885
US-11046698-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 USP2 2100/4885SMN1; SMN2 1145/4885RECQL 1421/4885
US-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 USP2 2100/4885SMN1; SMN2 1145/4885RECQL 1421/4885
US-20190031664-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 USP2 2100/4885SMN1; SMN2 1145/4885RECQL 1421/4885
US-10562906-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 USP2 2100/4885SMN1; SMN2 1145/4885RECQL 1421/4885
US-20230056447-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 USP2 2100/4885SMN1; SMN2 1145/4885RECQL 1421/4885
US-11008309-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof BCL6, MALT1, BTK USP2 4694/4885SMN1; SMN2 3038/4885RECQL 4729/4885
US-10399963-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof BCL6, MALT1, BTK USP2 4694/4885SMN1; SMN2 3038/4885RECQL 4729/4885
US-10570145-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 USP2 2100/4885SMN1; SMN2 1145/4885RECQL 1421/4885
US-20210403459-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK USP2 4694/4885SMN1; SMN2 3038/4885RECQL 4729/4885
US-10577373-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 USP2 2100/4885SMN1; SMN2 1145/4885RECQL 1421/4885
US-10562907-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 USP2 2100/4885SMN1; SMN2 1145/4885RECQL 1421/4885
US-20180186801-A1 SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 USP2 2195/4885SMN1; SMN2 2001/4885RECQL 1144/4885
US-20150238506-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF HTR2C, HTR3C, HTR3B USP2 3142/4885SMN1; SMN2 3017/4885RECQL 4484/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.