SCHEMBL10701931

SCHEMBL10701931

c1ccc(C(OCn2cncn2)c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 5/20 0.50
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 3/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
HTT P42858 1/20 0.44
HSP90AA1 P07900 1/20 0.44
ALDH1A1 P00352 3/20 0.43
TP53 P04637 2/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL10959984 0.75 CYP19A1 (0.56) CYP19A1MEN1KMT2ALMNAHTT
SCHEMBL6003706 0.74 ALDH1A1 (0.57) CYP19A1MEN1KMT2AKDM4ELMNA
SCHEMBL11210976 0.73 CYP19A1 (0.50) CYP19A1MEN1KMT2AKDM4ELMNA
SCHEMBL12462114 0.72 CYP19A1 (0.53) CYP19A1MEN1KMT2ALMNAHTT
SCHEMBL11127036 0.71 CYP19A1 (0.56) CYP19A1MEN1KMT2ALMNAHTT
SCHEMBL7783933 0.71 TSHR (0.58) CYP19A1MEN1KMT2ALMNAHTT
SCHEMBL5544140 0.71 TSHR (0.58) CYP19A1MEN1KMT2ALMNAHTT
SCHEMBL10926146 0.71 CYP19A1 (0.51) CYP19A1MEN1KMT2ALMNAHTT
SCHEMBL12309934 0.71 KMT2A (0.54) CYP19A1MEN1KMT2ALMNAHTT
SCHEMBL3035852 0.71 CYP19A1 (0.61) CYP19A1MEN1KMT2AKDM4ELMNA

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
CN-1046275-C 2-methoxyiminophenyl-N-methylacetamide derivatives, process for their preparation, their use and compositions containing them BASF AG (DE) 1999-11-10 CN disclosed
EP-0270138-A1 Substituted 2-phenylimino-oxazolidine compounds having herbicidal activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1988-06-08 EP disclosed