SCHEMBL11075362

SCHEMBL11075362

Cc1c(Cl)ccc(OC(C)C=CC(=O)Nc2ccccc2)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.47
RAB9A P51151 5/20 0.47
MAOB P27338 4/20 0.47
MAPT P10636 3/20 0.47
SMN1; SMN2 Q16637 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
STAT1 P42224 1/20 0.42
EGFR P00533 4/20 0.41
RORC P51449 2/20 0.41
ALDH1A1 P00352 2/20 0.40
HTT P42858 1/20 0.40
MMP1 P03956 3/20 0.40
MMP2 P08253 3/20 0.40
MMP9 P14780 3/20 0.40
MAOA P21397 2/20 0.40
KDM4E B2RXH2 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39

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
SCHEMBL11079719 0.92 NPC1 (0.46) NPC1RAB9AMAOBMAPTSMN1; SMN2
SCHEMBL11081516 0.90 NPC1 (0.44) NPC1RAB9AMAOBMAPTSMN1; SMN2
SCHEMBL11086916 0.82 MAOB (0.46) NPC1RAB9AMAOBMAPTSMN1; SMN2
SCHEMBL11074180 0.82 MAOB (0.46) NPC1RAB9AMAOBMAPTSMN1; SMN2
SCHEMBL11074044 0.81 MAOB (0.42) NPC1RAB9AMAOBMAPTSMN1; SMN2
SCHEMBL11076582 0.80 MAPT (0.43) NPC1RAB9AMAOBMAPTSMN1; SMN2
SCHEMBL11077507 0.79 KDM4E (0.53) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL11087457 0.77 CTSD (0.45) NPC1RAB9AMAOBMAPTSMN1; SMN2
SCHEMBL11087465 0.77 CTSD (0.45) NPC1RAB9AMAOBMAPTSMN1; SMN2
SCHEMBL11075448 0.74 HDAC3 (0.45) RAB9ARORCTHRBCYP1A2CYP3A4

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
US-4465507-A Herbicidal acetanilides MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1984-08-14 US disclosed