SCHEMBL9158409

SCHEMBL9158409

CCOc1ccc2c(c1)C(C)=CC(C)(C)N2Cc1ccc(CN2c3ccc(OCC)cc3C(C)=CC2(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.56
KDM4E B2RXH2 8/20 0.56
MAPT P10636 8/20 0.56
ALOX12 P18054 6/20 0.56
HTT P42858 5/20 0.56
GAA P10253 4/20 0.56
HSD17B10 Q99714 3/20 0.56
TSHR P16473 1/20 0.56
CASP1 P29466 1/20 0.56
L3MBTL1 Q9Y468 3/20 0.55
HPGD P15428 5/20 0.52
TDP1 Q9NUW8 4/20 0.52
THRB P10828 2/20 0.52
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48

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
SCHEMBL9159099 0.96 L3MBTL1 (0.60) ALDH1A1KDM4EMAPTALOX12HTT
SCHEMBL9159717 0.88 ALDH1A1 (0.59) ALDH1A1KDM4EMAPTALOX12HTT
SCHEMBL9166743 0.86 MAPT (0.53) ALDH1A1KDM4EMAPTALOX12HTT
SCHEMBL29838742 0.82 ALDH1A1 (0.62) ALDH1A1KDM4EMAPTALOX12HTT
SCHEMBL26503069 0.82 ALDH1A1 (0.62) ALDH1A1KDM4EMAPTALOX12HTT
SCHEMBL502503 0.81 ALDH1A1 (0.53) ALDH1A1KDM4EMAPTALOX12HTT
SCHEMBL11589918 0.77 ALDH1A1 (0.57) ALDH1A1KDM4EMAPTALOX12HTT
SCHEMBL9845705 0.77 ALDH1A1 (0.57) ALDH1A1KDM4EMAPTALOX12HTT
SCHEMBL11332800 0.77 ALDH1A1 (0.73) ALDH1A1KDM4EMAPTALOX12HTT
SCHEMBL11328327 0.77 ALDH1A1 (0.51) ALDH1A1KDM4EMAPTALOX12HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0428214-B1 Electrophotographic recording material AGFA GEVAERT NV (BE) 1995-03-29 EP disclosed
EP-0393787-B1 Electrophotographic recording material AGFA GEVAERT NV (BE) 1995-02-15 EP disclosed
US-5145759-A Conductive support, negatively chargeable photoconductive layer containing insulating polymeric binder with pigment and charge transport substance AGFA-GEVAERT, N.V. (BE) 1992-09-08 US disclosed
US-5134048-A Optical recording media and light sensitive elements AGFA-GEVAERT, N.V. (BE) 1992-07-28 US disclosed
US-5128227-A Electrography, improved chargability AGFA-GEVAERT, N.V. (BE) 1992-07-07 US disclosed
EP-0428214-A1 Electrophotographic recording material AGFA-GEVAERT N.V. (BE) 1991-05-22 EP disclosed
EP-0393787-A2 Electrophotographic recording material AGFA-GEVAERT N.V. (BE) 1990-10-24 EP disclosed