SCHEMBL30989232

SCHEMBL30989232

O=C(O)c1cccc(CSc2cccs2)c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 4/20 0.55
SMN1; SMN2 Q16637 6/20 0.53
HTT P42858 1/20 0.53
AR P10275 1/20 0.52
MRGPRX4 Q96LA9 1/20 0.52
RAB9A P51151 2/20 0.51
FOLH1 Q04609 1/20 0.49
RXFP1 Q9HBX9 1/20 0.48
HPGD P15428 2/20 0.46
MAPT P10636 1/20 0.46
CSNK2A2 P19784 1/20 0.46
CSNK2B P67870 1/20 0.46
CSNK2A1 P68400 1/20 0.46
PTPRC P08575 1/20 0.45
PTPRG P23470 1/20 0.45
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL21119057 1.00 ACMSD (0.55) ACMSDSMN1; SMN2HTTARMRGPRX4
SCHEMBL3047534 0.77 HPGD (0.50) SMN1; SMN2HTTRAB9AHPGDMAPT
SCHEMBL6347118 0.76 SMN1; SMN2 (0.60) ACMSDSMN1; SMN2HTTARMRGPRX4
SCHEMBL12581571 0.76 APEX1 (0.65) ACMSDSMN1; SMN2HTTARMRGPRX4
SCHEMBL39630 0.76 FOLH1 (0.63) SMN1; SMN2HTTARMRGPRX4RAB9A
SCHEMBL1122756 0.74 KMT2A (0.55) RAB9AMAPTNPC1
SCHEMBL30760312 0.74 FOLH1 (0.53) MRGPRX4FOLH1HPGDLMNA
SCHEMBL29130688 0.74 FOLH1 (0.53) MRGPRX4FOLH1HPGDLMNA
SCHEMBL315037 0.73 SMN1; SMN2 (0.68) ACMSDSMN1; SMN2HTTARMRGPRX4
SCHEMBL46936 0.73 FOLH1 (0.59) SMN1; SMN2HTTARMRGPRX4RAB9A

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
CN-118339274-A Brandy replica 艾娃食品实验室股份有限公司 2024-07-12 CN disclosed