SCHEMBL11005893

SCHEMBL11005893

Clc1ccc(C2=CN3c4ccccc4SC3N2Cl)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 2/20 0.34
▸ BCHE P06276 2/20 0.33
▸ CACNA1C Q13936 1/20 0.33
▸ HPGD P15428 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP1A2 P05177 1/20 0.32
▸ APAF1 O14727 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ ALOX12 P18054 1/20 0.30
▸ CASP3 P42574 1/20 0.30
▸ SENP8 Q96LD8 1/20 0.30
▸ SENP7 Q9BQF6 1/20 0.30
▸ SENP6 Q9GZR1 1/20 0.30

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
SCHEMBL11008993 0.84 GSK3B (0.34) GSK3BBCHECACNA1CHPGDL3MBTL1
SCHEMBL11008882 0.84 GSK3B (0.34) GSK3BBCHECACNA1CHPGDL3MBTL1
SCHEMBL11012110 0.83 GSK3B (0.36) GSK3BBCHECACNA1CHPGDL3MBTL1
SCHEMBL11007770 0.81 BCHE (0.33) GSK3BBCHECACNA1CHPGDL3MBTL1
SCHEMBL11006018 0.81 GSK3B (0.37) GSK3BBCHECACNA1CHPGDL3MBTL1
SCHEMBL11011280 0.81 CACNA1C (0.35) GSK3BBCHECACNA1CHPGDL3MBTL1
SCHEMBL11011669 0.81 GSK3B (0.34) GSK3BBCHECACNA1CHPGDL3MBTL1
SCHEMBL11011707 0.79 GSK3B (0.39) GSK3BBCHECACNA1CHPGDL3MBTL1
SCHEMBL9569356 0.79 CACNA1C (0.39) GSK3BBCHECACNA1CHPGDL3MBTL1
SCHEMBL11012227 0.76 CACNA1C (0.31) BCHECACNA1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4497817-A ANTIALLERGENS-IMMUNOSUPPRESSIVE AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1985-02-05 — — US disclosed
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