SCHEMBL20049786

SCHEMBL20049786

CCOC(=O)c1nscc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53
ALDH1A1 P00352 8/20 0.49
CYP1A2 P05177 2/20 0.49
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MAPT P10636 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
HSD17B10 Q99714 3/20 0.45
HPGD P15428 3/20 0.44
GAA P10253 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAOA P21397 1/20 0.43
KDM4E B2RXH2 2/20 0.42
FHIT P49789 1/20 0.41
MAPK1 P28482 1/20 0.41
CDC7 O00311 1/20 0.40
DBF4 Q9UBU7 1/20 0.40

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
Hydrochloric Acid SCHEMBL28793318 0.98 TDP1 (0.56) TDP1ALDH1A1CYP1A2MEN1KMT2A
SCHEMBL13468179 0.82 KDM4E (0.44) ALDH1A1CYP1A2MEN1KMT2AMAPT
SCHEMBL13469118 0.81 KDM4E (0.43) ALDH1A1CYP1A2MEN1KMT2AMAPT
SCHEMBL4703254 0.81 CA12 (0.46) ALDH1A1CYP1A2MEN1KMT2AMAPT
SCHEMBL16571310 0.79 HSD17B2 (0.44) ALDH1A1CYP1A2MEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL9369833 0.79 TDP1 (0.61) TDP1ALDH1A1MEN1KMT2AMAPT
SCHEMBL15614506 0.77 KDM4E (0.40) ALDH1A1CYP1A2MEN1KMT2AMAPT
SCHEMBL9632139 0.75 TSHR (0.46) ALDH1A1CYP1A2MEN1KMT2AMAPT
SCHEMBL3868869 0.71 TSHR (0.50) ALDH1A1CYP1A2MEN1KMT2AMAPT
SCHEMBL2843820 0.71 ALDH1A1 (0.59) ALDH1A1CYP1A2MEN1KMT2AMAPT

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 17 patents. 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
EP-3523305-B1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2021-12-08 EP disclosed
US-11046698-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2021-06-29 US disclosed
US-10836770-B2 Imidazopyridazine compounds useful as modulators of IL-12, IL-23 and/or INF alpha responses BRISTOL-MYERS SQUIBB COMPANY (US) 2020-11-17 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-10562906-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-02-18 US disclosed
US-10562907-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-02-18 US disclosed
US-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-22 US disclosed
US-20190248797-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-15 US disclosed
US-20190241576-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-08 US disclosed
US-20190241577-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-08 US disclosed
US-20190241575-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-08 US disclosed
US-20190225620-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2019-07-25 US disclosed
WO-2019023468-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2019-01-31 WO disclosed
US-20190031664-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-01-31 US disclosed
WO-2018067432-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL-MYERS SQUIBB COMPANY (US) 2018-04-12 WO 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 (14 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-20190225620-A1 IMIDAZOPYRIDAZINE COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES TYK2, IL2, IFNAR1 TDP1 1506/4885ALDH1A1 3821/4885CYP1A2 692/4885
US-20190248797-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-11046698-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-20190031664-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-20190241577-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-10562906-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-20190241576-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-20190241575-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-20230056447-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-10570145-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-10577373-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-10562907-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 TDP1 330/4885ALDH1A1 4827/4885CYP1A2 3935/4885
US-10836770-B2 Imidazopyridazine compounds useful as modulators of IL-12, IL-23 and/or INF alpha responses TYK2, IL2, IFNAR1 TDP1 2207/4885ALDH1A1 3818/4885CYP1A2 795/4885

“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.