SCHEMBL7020062

SCHEMBL7020062

Nc1ccc(Oc2ccc(-c3ccc(O)cc3)cc2)c(N)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
CYP2D6 P10635 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TAAR5 O14804 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
ESR2 Q92731 3/20 0.43
ESR1 P03372 2/20 0.43
CYP3A4 P08684 3/20 0.41
CA3 P07451 1/20 0.40
THRB P10828 1/20 0.40
ALOX15 P16050 1/20 0.40
CA6 P23280 1/20 0.40

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
SCHEMBL7024360 0.95 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL27741074 0.91 MAPT (0.53) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL28806097 0.91 MAPT (0.53) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL7806773 0.85 MAPT (0.59) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL7015396 0.84 CYP3A4 (0.54) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL29866044 0.84 CYP3A4 (0.54) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL14626482 0.83 ESR2 (0.43) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL30744926 0.83 MAPT (0.57) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL362820 0.83 MAPT (0.57) ALDH1A1MEN1KMT2ACYP1A2CYP2C9
SCHEMBL14337759 0.83 TEAD4 (0.55) ALDH1A1MEN1KMT2ACYP1A2CYP2C9

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0682283-B1 Liquid crystal alignment film NISSAN CHEMICAL IND LTD (JP) 2003-01-15 EP disclosed
US-5608033-A POLYIMIDES NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1997-03-04 US disclosed
EP-0682283-A1 Liquid crystal alignment film NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1995-11-15 EP disclosed