SCHEMBL9722964

SCHEMBL9722964

CNc1cc(Cl)c(OC)cc1C(=O)CSC

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ KMT2A Q03164 5/20 0.41
▸ MAPT P10636 4/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ HPGD P15428 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
SCHEMBL9722927 0.79 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2KMT2AMAPTMEN1
SCHEMBL9722955 0.78 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2KMT2AMAPTMEN1
SCHEMBL9722968 0.75 MEN1 (0.38) ALDH1A1SMN1; SMN2KMT2AMAPTMEN1
SCHEMBL10953312 0.74 KDM4E (0.50) ALDH1A1SMN1; SMN2KMT2AMAPTMEN1
SCHEMBL9796480 0.71 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2KMT2AMAPTMEN1
SCHEMBL9722911 0.69 IKBKB (0.38) ALDH1A1SMN1; SMN2KMT2AMAPTMEN1
SCHEMBL28131348 0.68 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2KMT2AMAPTMEN1
SCHEMBL10556328 0.67 SMN1; SMN2 (0.46) ALDH1A1SMN1; SMN2KMT2AKDM4ELMNA
SCHEMBL19089279 0.67 NPC1 (0.52) ALDH1A1SMN1; SMN2KMT2AMAPTMEN1
SCHEMBL14382356 0.67 SMN1; SMN2 (0.53) ALDH1A1SMN1; SMN2KMT2AMEN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5079264-A CHEMICAL PROCESS THE BOOTS CO. PLC (GB) 1992-01-07 — — US disclosed
EP-0317149-B1 PROCESS FOR THE SYNTHESIS OF 3-THIO-4-QUINOLONE DERIVATIVES AND INTERMEDIATE COMPOUNDS FOR USE THEREIN, AND THEIR USE AS MEDICAMENTS The Boots Company PLC (GB) 1991-11-06 — — EP disclosed
US-5011931-A For treatment of cardiovascular disorders; hypotensive agents THE BOOTS COMPANY PLC (GB) 1991-04-30 — — US disclosed
EP-0343206-A1 PROCESS FOR THE SYNTHESIS OF 3-THIO-4-QUINOLONE DERIVATIVES AND INTERMEDIATE COMPOUNDS FOR USE THEREIN, AND THEIR USE AS MEDICAMENTS The Boots Company PLC (GB) 1989-11-29 — — EP disclosed
EP-0317149-A1 Process for the synthesis of 3-thio-4-quinolone derivatives and intermediate compounds for use therein, and their use as medicaments The Boots Company PLC (GB) 1989-05-24 — — EP disclosed
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