SCHEMBL30597550

SCHEMBL30597550

Cc1cc(C)c2sc(NC(=O)C3CCN(S(=O)(=O)c4ccc(F)nc4)CC3)nc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.59
▸ KMT2A Q03164 5/20 0.59
▸ NPC1 O15118 2/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ MAPT P10636 6/20 0.56
▸ SMN1; SMN2 Q16637 7/20 0.56
▸ LMNA P02545 4/20 0.56
▸ CLK1 P49759 1/20 0.56
▸ CHRM5 P08912 1/20 0.50
▸ MAPK1 P28482 3/20 0.49
▸ HPGD P15428 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ HTT P42858 2/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL30597543 0.89 MEN1 (0.63) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL30597504 0.88 MAPT (0.63) MEN1KMT2ANPC1MAPTSMN1; SMN2
SCHEMBL30597554 0.88 MEN1 (0.61) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL30597541 0.88 MEN1 (0.61) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL30597531 0.88 MEN1 (0.61) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL30597500 0.86 L3MBTL1 (0.63) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL30597494 0.85 MEN1 (0.60) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL30597506 0.85 MEN1 (0.62) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL30597519 0.85 MEN1 (0.62) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL30597552 0.84 NPC1 (0.61) MEN1KMT2ANPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023201014-A1 BENZOTHIAZOLE-PHENYLSULFONYL-PIPERIDINE ANALOGS AS ACTIVATORS OF N-ACYLPHOSPHATIDYLETHANOLAMINE HYDROLYZING PHOSPHOLIPASE D VANDERBILT UNIVERSITY (US) 2023-10-19 — — WO claimed
WO-2023201014-A1 BENZOTHIAZOLE-PHENYLSULFONYL-PIPERIDINE ANALOGS AS ACTIVATORS OF N-ACYLPHOSPHATIDYLETHANOLAMINE HYDROLYZING PHOSPHOLIPASE D VANDERBILT UNIVERSITY (US) 2023-10-19 — — WO disclosed
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