SCHEMBL391396

SCHEMBL391396

O=S(=O)(c1cc[c]cc1)N1CCOCC1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.68
LMNA P02545 4/20 0.62
SMN1; SMN2 Q16637 3/20 0.62
GAA P10253 3/20 0.60
KMT2A Q03164 2/20 0.60
MEN1 O00255 1/20 0.60
HTT P42858 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.55
MAPK1 P28482 1/20 0.55
ALDH1A1 P00352 2/20 0.54
KDM4E B2RXH2 2/20 0.54
HSD17B10 Q99714 2/20 0.54
TSHR P16473 2/20 0.54
USP2 O75604 1/20 0.54
APOBEC3G Q9HC16 1/20 0.53

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
SCHEMBL12793245 0.86 POLB (0.88) POLBLMNASMN1; SMN2GAAKMT2A
SCHEMBL421626 0.82 USP2 (0.63) POLBLMNAGAAKMT2AMEN1
SCHEMBL1229961 0.82 USP2 (0.69) POLBLMNASMN1; SMN2GAAKMT2A
SCHEMBL12793258 0.81 POLB (1.00) POLBLMNASMN1; SMN2GAAKMT2A
SCHEMBL5960399 0.81 POLB (0.80) POLBLMNASMN1; SMN2GAAKMT2A
SCHEMBL76639 0.81 USP2 (0.73) POLBLMNASMN1; SMN2GAAKMT2A
SCHEMBL2122633 0.81 USP2 (0.73) POLBLMNASMN1; SMN2GAAKMT2A
Water SCHEMBL28009498 0.80 POLB (0.71) POLBLMNASMN1; SMN2GAAKMT2A
SCHEMBL1419418 0.80 POLB (0.56) POLBLMNASMN1; SMN2GAAKMT2A
SCHEMBL8871272 0.79 POLB (0.76) POLBLMNASMN1; SMN2GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210403459-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. 2021-12-30 US claimed
CN-105980386-B Pyrazolo compounds and uses thereof 基因泰克公司 2021-08-13 CN claimed
EP-2970307-B1 PYRAZOLO COMPOUNDS AND USES THEREOF GENENTECH INC (US) 2020-03-11 EP claimed
CN-110546140-A selective HDAC6 inhibitors ITALFARMACO SPA 2019-12-06 CN claimed
US-10035801-B2 Pyrazolo compounds and uses thereof GENENTECH, INC. (US) 2018-07-31 US claimed
WO-2018042377-A1 NOVEL INDAZOLE COMPOUNDS TORRENT PHARMACEUTICALS LIMITED (IN) 2018-03-08 WO claimed
US-20170273954-A1 METHODS AND COMPOSITIONS FOR BACTERIA INFECTIONS THE UNIVERSITY OF CHICAGO (US) 2017-09-28 US claimed
US-9675592-B2 Methods and compositions for bacteria infections THE UNIVERSITY OF CHICAGO (US) 2017-06-13 US claimed
CN-105980386-A Pyrazolo compounds and uses thereof 基因泰克公司 2016-09-28 CN claimed
US-20160120852-A1 METHODS AND COMPOSITIONS FOR BACTERIA INFECTIONS THE BOARD OF REGENTS OF THE UNIVERSITY OF ILLINOIS (US) 2016-05-05 US claimed
EP-1309589-A2 UREA COMPOUNDS AND METHODS OF USES Amgen Inc. (US) 2003-05-14 EP claimed
US-20020173507-A1 Urea compounds and methods of uses AMGEN INC. 2002-11-21 US claimed
WO-2002014311-A2 UREA COMPOUNDS AND METHODS OF USES AMGEN INC. (US) 2002-02-21 WO claimed
EP-1064274-A1 BENZENESULFONAMIDE DERIVATIVES AND THEIR USE AS MEDICAMENTS AstraZeneca AB (SE) 2001-01-03 EP claimed
EP-1029872-A1 PIPERAZINE-CYCLODEXTRIN COMPLEXES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-08-23 EP claimed
WO-1999047508-A1 BENZENESULFONAMIDE-DERIVATIVES AND THEIR USE AS MEDICAMENTS ASTRAZENECA AB (SE) 1999-09-23 WO claimed
EP-0624584-B1 Piperazine derivatives useful as calmodulin inhibitors DAIICHI SEIYAKU CO (JP) 1998-08-19 EP claimed
US-5681954-A HAS CALMODULIN INHIBITORY ACTIVITY; USEFUL IN TREATING DISEASES OF THE CIRCULATORY ORGANS OR IN CEREBRAL REGION DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-10-28 US claimed
US-5371074-A Use of saccharin derivatives as proteolytic enzyme inhibitors STERLING WINTHROP INC. (US) 1994-12-06 US claimed
EP-0624584-A1 Piperazine derivatives useful as calmodolin inhibitors DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1994-11-17 EP claimed

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

For each of this compound's patents that has machine-readable text (5 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-20170273954-A1 METHODS AND COMPOSITIONS FOR BACTERIA INFECTIONS SPOUT1, OXA1L, VSIR POLB 90/4885LMNA 1893/4885SMN1; SMN2 1662/4885
US-10035801-B2 Pyrazolo compounds and uses thereof KDM5A, KDM5C, KDM5B POLB 2395/4885LMNA 2737/4885SMN1; SMN2 1532/4885
US-20020173507-A1 Urea compounds and methods of uses SLC14A1, UMPS, BAX POLB 1093/4885LMNA 1241/4885SMN1; SMN2 869/4885
US-20210403459-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK POLB 4326/4885LMNA 1603/4885SMN1; SMN2 3038/4885
US-20160120852-A1 METHODS AND COMPOSITIONS FOR BACTERIA INFECTIONS SPOUT1, OXA1L, VSIR POLB 90/4885LMNA 1893/4885SMN1; SMN2 1662/4885

“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.