SCHEMBL7020181

SCHEMBL7020181

N#Cc1ccc(Oc2ccc(N)cc2N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.46
MAPT P10636 4/20 0.46
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 3/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP2D6 P10635 1/20 0.46
HPGD P15428 1/20 0.46
PARP15 Q460N3 1/20 0.44
PARP10 Q53GL7 1/20 0.44
PARP2 Q9UGN5 1/20 0.44
USP2 O75604 1/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
CA12 O43570 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
SCHEMBL7019500 0.95 SCN9A (0.44) ARMAPTKDM4EALDH1A1CYP1A2
SCHEMBL7806773 0.85 MAPT (0.59) MAPTKDM4EALDH1A1CYP1A2CYP2C9
SCHEMBL28690740 0.85 KDM4E (0.57) ARMAPTKDM4EALDH1A1PARP15
SCHEMBL20155262 0.83 AR (0.51) ARKDM4EALDH1A1SMN1; SMN2PARP15
SCHEMBL15067954 0.83 FFAR1 (0.47) ARMAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL11424391 0.83 MERTK (0.49) ARMAPTKDM4EALDH1A1CYP1A2
SCHEMBL2964216 0.83 MAPT (0.70) ARMAPTKDM4EALDH1A1CYP1A2
SCHEMBL362820 0.83 MAPT (0.57) MAPTKDM4EALDH1A1CYP1A2CYP2C9
SCHEMBL30744926 0.83 MAPT (0.57) MAPTKDM4EALDH1A1CYP1A2CYP2C9
SCHEMBL31439080 0.83 SLC6A4 (0.44) ARMAPTKDM4EALDH1A1SMN1; SMN2

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