SCHEMBL7292209

SCHEMBL7292209

c1ccc2c(c1)SCc1ccnnc1-2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 5/20 0.43
▸ NOTUM Q6P988 1/20 0.38
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ ADAMTS5 Q9UNA0 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ CHRM2 P08172 1/20 0.35
▸ ADRA2A P08913 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CHRM1 P11229 1/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ ADRA2B P18089 1/20 0.35
▸ ADRA2C P18825 1/20 0.35
▸ CHRM3 P20309 1/20 0.35
▸ SLC6A2 P23975 1/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35

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
SCHEMBL9780125 0.73 KDR (0.42) KDRNOTUMCA12CA1CA2
SCHEMBL9674642 0.71 METAP2 (0.47) ALDH1A1CYP2D6ACHEMEN1KMT2A
SCHEMBL23143475 0.71 CYP11B2 (0.44) ALDH1A1CHRM2CHRM1DRD2HTR2A
SCHEMBL30276323 0.69 KMT2A (0.46) NOTUMALDH1A1CHRM2ADRA2ACYP2D6
SCHEMBL216973 0.69 ACHE (0.56) KDRNOTUMALDH1A1CHRM2ADRA2A
SCHEMBL23143476 0.68 DRD4 (0.47) MIFMAOB
SCHEMBL27716995 0.67 KDR (0.42) KDRNOTUMCA12CA1CA2
SCHEMBL10610934 0.67 ADAMTS5 (0.40) KDRNOTUMCA12CA1CA2
SCHEMBL28952687 0.67 ACHE (0.44) KDRCA12CA1CA2CA9
SCHEMBL10612295 0.66 KDR (0.38) KDRNOTUMCA12CA1CA2

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4843075-A ANXIOLYTIC YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-06-27 — — US claimed
EP-0252990-A1 BENZOTHIOPYRANO(4,3-C)PYRIDAZINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-01-20 — — EP claimed
EP-0426018-B1 Thiophene compounds and their pharmaceutical uses YOSHITIOMI PHARMACEUTICAL IND (JP) 1997-08-27 — — EP disclosed
EP-0729960-A1 Thiophene compounds and their use as intermediates in the preparation of antianxiety drugs, hypnotics, antiepileptic drugs and nuotropics YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-09-04 — — EP disclosed
EP-0351435-B1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1993-08-04 — — EP disclosed
US-5175162-A Anxiolytic, antiepilepic agents YOSHITIOMI PHARMACEUTICAL INDUSTRIES LTD. (JP) 1992-12-29 — — US disclosed
US-5045541-A Immunodeficiency disorders YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-09-03 — — US disclosed
EP-0426018-A2 Thiophene compounds and their pharmaceutical uses YOSHITIOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-05-08 — — EP disclosed
EP-0351435-A1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-24 — — EP disclosed
US-4843075-A ANXIOLYTIC YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-06-27 — — US disclosed
US-4843075-A ANXIOLYTIC YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-06-27 — — US disclosed
US-4843075-A ANXIOLYTIC YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-06-27 — — US disclosed
EP-0252990-A4 BENZOTHIOPYRANO(4,3-C)PYRIDAZINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE. YOSHITOMI PHARMACEUTICAL (JP) 1989-06-14 — — EP disclosed
EP-0252990-A1 BENZOTHIOPYRANO(4,3-C)PYRIDAZINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-01-20 — — EP disclosed
EP-0252990-A1 BENZOTHIOPYRANO(4,3-C)PYRIDAZINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-01-20 — — EP disclosed
WO-1987004162-A1 BENZOTHIOPYRANO(4,3-C)PYRIDAZINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION, AND THEIR USE YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1987-07-16 — — WO disclosed
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