SCHEMBL30597510

SCHEMBL30597510

Cc1cc(C)c2nc(NC(=O)C3CCN(S(=O)(=O)c4ccc(C)c(F)c4)CC3)sc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.65
▸ SMN1; SMN2 Q16637 10/20 0.54
▸ LMNA P02545 7/20 0.54
▸ ALDH1A1 P00352 5/20 0.54
▸ KDM4E B2RXH2 4/20 0.54
▸ L3MBTL1 Q9Y468 4/20 0.54
▸ HTT P42858 3/20 0.54
▸ TDP1 Q9NUW8 3/20 0.54
▸ POLB P06746 2/20 0.54
▸ CLK1 P49759 2/20 0.53
▸ ADORA2A P29274 1/20 0.53
▸ HPGD P15428 2/20 0.52
▸ USP2 O75604 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ KMT2A Q03164 6/20 0.52
▸ MAPK1 P28482 5/20 0.52
▸ MEN1 O00255 5/20 0.52
▸ CTDSP1 Q9GZU7 1/20 0.52
▸ GAA P10253 2/20 0.51

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
SCHEMBL30597557 0.94 MAPT (0.65) MAPTSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL30597537 0.91 MAPT (0.63) MAPTSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL30597528 0.90 MAPT (0.73) MAPTSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL30597492 0.88 MAPT (0.62) MAPTSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL30597508 0.88 MAPT (0.66) MAPTSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL30597504 0.88 MAPT (0.63) MAPTSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL30597531 0.87 MEN1 (0.61) MAPTSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL30597532 0.87 MAPT (0.70) MAPTSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL30597555 0.85 MAPT (0.68) MAPTSMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL30597501 0.85 MAPT (0.65) MAPTSMN1; SMN2LMNAALDH1A1KDM4E

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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