SCHEMBL7325044

SCHEMBL7325044

[c]1nc(-c2ccccc2-c2ccccc2)cs1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A2 O94788 1/20 0.35
▸ ALDH1A3 P47895 1/20 0.35
▸ ALDH1A1 P00352 5/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ CYP2A6 P11509 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ BCL2L1 Q07817 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CYP2B6 P20813 1/20 0.34
▸ GPR55 Q9Y2T6 1/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ SENP8 Q96LD8 1/20 0.34
▸ SENP7 Q9BQF6 1/20 0.34
▸ SENP6 Q9GZR1 1/20 0.34
▸ NISCH Q9Y2I1 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HTT P42858 1/20 0.33

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
SCHEMBL70645 0.84 ALDH1A1 (0.42) ALDH1A1HSD17B10HPGDSMN1; SMN2RAB9A
SCHEMBL5540279 0.80 RAB9A (0.47) ALDH1A2ALDH1A3ALDH1A1HSD17B10CYP2A6
SCHEMBL17626029 0.77 MPL (0.49) ALDH1A1SMN1; SMN2RAB9ACASP3SENP8
SCHEMBL2201317 0.77 IDO1 (0.43) ALDH1A1HSD17B10CYP2A6HPGDSMN1; SMN2
SCHEMBL7227702 0.77 IDO1 (0.42) ALDH1A1HSD17B10HPGDMAPK1SMN1; SMN2
SCHEMBL27752088 0.75 RAB9A (0.51) ALDH1A1HPGDSMN1; SMN2RAB9AMAPT
SCHEMBL3858714 0.74 HTR2C (0.40) ALDH1A1HSD17B10HPGDMAPK1SMN1; SMN2
SCHEMBL17625965 0.74 LMNA (0.43) ALDH1A1MAPK1SMN1; SMN2RAB9AHTT
SCHEMBL5660459 0.73 VCP (0.42) ALDH1A1HPGD
SCHEMBL1435851 0.73 CYP19A1 (0.47) ALDH1A1HSD17B10HPGDSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0343894-B1 BENZAMIDE PROTEASE INHIBITORS PFIZER INC. (US) 1992-06-10 — — EP claimed
US-4948891-A ANTI-PLASMIN AND ANTI-THROMBIN AGENTS PFIZER INC. (US) 1990-08-14 — — US claimed
EP-0343894-A1 Benzamide protease inhibitors PFIZER INC. (US) 1989-11-29 — — EP claimed
EP-0343894-B1 BENZAMIDE PROTEASE INHIBITORS PFIZER INC. (US) 1992-06-10 — — EP disclosed
US-4948901-A ANTI-PLASMIN AND ANTI-THROMBIN AGENTS PFIZER INC. (US) 1990-08-14 — — US disclosed
US-4948891-A ANTI-PLASMIN AND ANTI-THROMBIN AGENTS PFIZER INC. (US) 1990-08-14 — — US disclosed
EP-0343894-A1 Benzamide protease inhibitors PFIZER INC. (US) 1989-11-29 — — EP disclosed
US-4874864-A ANTIPLASMIN, ANTITHROMBIN AGENTS PFIZER INC. (US) 1989-10-17 — — US disclosed
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