SCHEMBL9831386

SCHEMBL9831386

CCC(N)(CCSc1ccc(Cl)cc1)c1cccs1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ LMNA P02545 3/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ NPSR1 Q6W5P4 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ HTT P42858 4/20 0.35
▸ PKM P14618 2/20 0.35
▸ ESR1 P03372 1/20 0.34
▸ POLB P06746 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ FDPS P14324 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ TEAD1 P28347 1/20 0.32
▸ YAP1 P46937 1/20 0.32
▸ TEAD4 Q15561 1/20 0.32
▸ TEAD2 Q15562 1/20 0.32
▸ MEN1 O00255 3/20 0.32

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
SCHEMBL9833086 0.88 NPC1 (0.38) MAPTKMT2ALMNAALDH1A1NPSR1
SCHEMBL9834177 0.81 MAPT (0.42) MAPTKMT2ALMNAALDH1A1NPSR1
SCHEMBL9833650 0.80 MAPT (0.41) MAPTKMT2ALMNAALDH1A1NPSR1
SCHEMBL9832757 0.76 TUBB4A (0.38) MAPTKMT2ALMNAALDH1A1HPGD
SCHEMBL9831796 0.68 NPC1 (0.35) MAPTKMT2ALMNAALDH1A1NPSR1
SCHEMBL9832379 0.68 NPC1 (0.35) MAPTALDH1A1HPGDESR1RAB9A
SCHEMBL3883354 0.65 CA12 (0.52) MAPTKMT2ALMNAALDH1A1NPSR1
SCHEMBL15368479 0.65 ESR1 (0.49) MAPTKMT2AALDH1A1ESR1TSHR
SCHEMBL9808062 0.64 TEAD1 (0.53) MAPTKMT2ALMNAALDH1A1NPSR1
SCHEMBL6975653 0.63 KIF11 (0.40) MAPTKMT2ALMNAALDH1A1HPGD

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
CN-1021051-C THIOPHENE DERIVATIVE AND PROCESS FOR PREPARING SAME TANABE SEIYAKU CO (JP) 1993-06-02 — — CN disclosed
EP-0297782-B1 A THIOPHENE DERIVATIVE AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 1991-05-22 — — EP disclosed
US-4857543-A TREATMENT OF GASTROINTESTINAL DISORDERS TANABE SEIYAKU CO., LTD. (JP) 1989-08-15 — — US disclosed
CN-1030584-A Novel thiophene derivant and preparation method thereof TANABE SEIYAKU CO (JP) 1989-01-25 — — CN disclosed
EP-0297782-A1 A thiophene derivative and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1989-01-04 — — EP disclosed
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