SCHEMBL1951997

SCHEMBL1951997

COc1ccc(SCC=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.47
MTNR1B P49286 1/20 0.47
APP P05067 1/20 0.47
ALDH1A1 P00352 4/20 0.47
CYP2A6 P11509 1/20 0.47
CYP1A1 P04798 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP1B1 Q16678 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
DAO P14920 1/20 0.44
KDM4E B2RXH2 2/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
NPC1 O15118 2/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL3831691 0.87 MTNR1A (0.39) MTNR1AMTNR1BAPPALDH1A1CYP2A6
SCHEMBL11287405 0.81 MTNR1A (0.53) MTNR1AMTNR1BAPPALDH1A1CYP2A6
SCHEMBL3890971 0.80 TP53 (0.52) MTNR1AMTNR1BAPPALDH1A1CYP1A1
SCHEMBL911004 0.78 MTNR1A (0.52) MTNR1AMTNR1BCYP1A1CYP1A2CYP1B1
SCHEMBL10903718 0.77 APP (0.45) MTNR1AMTNR1BAPPALDH1A1CYP1A1
SCHEMBL2554286 0.77 ALDH1A1 (0.43) ALDH1A1CYP2A6CYP1A2KDM4ENPC1
SCHEMBL418525 0.76 ALDH1A1 (0.59) MTNR1AMTNR1BAPPALDH1A1CYP1A1
SCHEMBL22531196 0.76 EPHX2 (0.40) ALDH1A1CA12CA1CA2CA9
SCHEMBL6123648 0.75 ALDH1A1 (0.54) MTNR1AMTNR1BAPPALDH1A1CYP1A2
SCHEMBL28527734 0.74 TRPA1 (0.52) APPALDH1A1CYP2A6CYP1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3953341-A1 NOVEL OXADIAZOLE COMPOUNDS FOR CONTROLLING OR PREVENTING PHYTOPATHOGENIC FUNGI PI Industries Ltd. (IN) 2022-02-16 EP claimed
US-20250223291-A1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS INCYTE CORPORATION 2025-07-10 US disclosed
US-12084449-B2 Imidazotriazines and imidazopyrimidines as kinase inhibitors INCYTE HOLDINGS CORPORATION (US) 2024-09-10 US disclosed
US-20230002392-A1 Imidazotriazines and Imidazopyrimidines as Kinase Inhibitors INCYTE CORPORATION 2023-01-05 US disclosed
US-11261191-B2 Imidazotriaines and imidazopyrimidines as kinase inhibitors INCYTE HOLDINGS CORPORATION (US) 2022-03-01 US disclosed
US-20200317680-A1 Imidazotriaines and Imidazopyrimidines as Kinase Inhibitors INCYTE HOLDINGS CORPORATION 2020-10-08 US disclosed
US-10738052-B2 Imidazotriaines and imidazopyrimidines as kinase inhibitors INCYTE HOLDINGS CORPORATION (US) 2020-08-11 US disclosed
EP-3443958-A1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS Incyte Holdings Corporation (US) 2019-02-20 EP disclosed
US-20180282340-A1 Imidazotriaines and Imidazopyrimidines as Kinase Inhibitors INCYTE CORPORATION 2018-10-04 US disclosed
EP-3034075-B1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS INCYTE HOLDINGS CORP (US) 2018-07-25 EP disclosed
CN-101641093-B Imidazotriazines and imidazopyrimidines as kinase inhibitors INCYTE CORP 2013-05-29 CN disclosed
EP-2099447-B1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS INCYTE CORP (US) 2012-11-07 EP disclosed
EP-2497470-A1 Imidazotriazines and imidazopyrimidines as kinase inhibitors Incyte Corporation (US) 2012-09-12 EP disclosed
US-20110136781-A1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS INCYTE CORPORATION (US) 2011-06-09 US disclosed
US-7767675-B2 Imidazotriazines and imidazopyrimidines as kinase inhibitors INCYTE CORPORATION (US) 2010-08-03 US disclosed
CN-101641093-A Imidazotriazines and imidazopyrimidines as kinase inhibitors INCYTE CORP US 2010-02-03 CN disclosed
EP-2099447-A1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS Incyte Corporation (US) 2009-09-16 EP disclosed
US-20080167287-A1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS INCYTE CORPORATION (US) 2008-07-10 US disclosed
WO-2008064157-A1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS INCYTE CORPORATION (US) 2008-05-29 WO disclosed
EP-0169581-B1 ANTITUSSIVE AND MUCUS REGULATING 2-SUBSTITUTED THIAZOLIDINES BOEHRINGER BIOCHEMIA ROBIN S.p.A. (IT) 1989-12-06 EP 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 (9 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-20230002392-A1 Imidazotriazines and Imidazopyrimidines as Kinase Inhibitors ERBB2, MERTK, ABL1 MTNR1A 926/4885MTNR1B 688/4885APP 3932/4885
US-20180282340-A1 Imidazotriaines and Imidazopyrimidines as Kinase Inhibitors MET, RET, ERBB2 MTNR1A 783/4885MTNR1B 591/4885APP 4239/4885
US-20250223291-A1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS ERBB2, MERTK, ABL1 MTNR1A 926/4885MTNR1B 688/4885APP 3932/4885
US-20200317680-A1 Imidazotriaines and Imidazopyrimidines as Kinase Inhibitors MET, RET, ERBB2 MTNR1A 783/4885MTNR1B 591/4885APP 4239/4885
US-20110136781-A1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS ERBB2, MERTK, ABL1 MTNR1A 926/4885MTNR1B 688/4885APP 3932/4885
US-12084449-B2 Imidazotriazines and imidazopyrimidines as kinase inhibitors ERBB2, MERTK, ABL1 MTNR1A 926/4885MTNR1B 688/4885APP 3932/4885
US-11261191-B2 Imidazotriaines and imidazopyrimidines as kinase inhibitors MET, RET, ERBB2 MTNR1A 783/4885MTNR1B 591/4885APP 4239/4885
US-20080167287-A1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS ERBB2, MERTK, ABL1 MTNR1A 926/4885MTNR1B 688/4885APP 3932/4885
US-10738052-B2 Imidazotriaines and imidazopyrimidines as kinase inhibitors MET, RET, ERBB2 MTNR1A 783/4885MTNR1B 591/4885APP 4239/4885

“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.