SCHEMBL9224669

SCHEMBL9224669

C=Cc1cccc(CSc2ccc(Cl)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
ALDH1A1 P00352 4/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MAOA P21397 3/20 0.43
MAOB P27338 3/20 0.43
SOD1 P00441 1/20 0.40
TDP1 Q9NUW8 5/20 0.38
MAPT P10636 4/20 0.38
GAA P10253 2/20 0.38
KDM4E B2RXH2 1/20 0.38
DAO P14920 1/20 0.38
TP53 P04637 1/20 0.37
L3MBTL1 Q9Y468 4/20 0.37
HPGD P15428 3/20 0.37
LMNA P02545 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL4459806 0.85 ALDH1A1 (0.43) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL8151125 0.76 TP53 (0.47) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL10339845 0.76 NPC1 (0.46) ALDH1A1NPC1RAB9ATDP1GAA
SCHEMBL28283253 0.74 MEN1 (0.66) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL19631194 0.73 MAOA (0.53) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL7171513 0.73 TP53 (0.48) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL83796 0.71 MEN1 (0.80) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL14732604 0.70 TP53 (0.46) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL8754968 0.70 ALDH1A1 (0.48) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL30206769 0.70 TP53 (0.48) MEN1KMT2AALDH1A1MAOAMAOB

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
JP-7133232-A None JP disclosed
JP-H07133232-A IMMUNOLOGICAL DIAGNOSTIC AND CARRIER NIPPON OIL & FATS CO LTD 1995-05-23 JP disclosed