SCHEMBL7164942

SCHEMBL7164942

CCCCN1c2ccccc2Nc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.46
HPGD P15428 2/20 0.45
KDM1A O60341 1/20 0.45
ALDH1A1 P00352 5/20 0.45
KMT2A Q03164 3/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 2/20 0.45
ALDH2 P05091 1/20 0.45
ALDH3A1 P30838 1/20 0.45
MAPT P10636 1/20 0.45
ALOX12 P18054 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
CES1 P23141 2/20 0.44
CDC25A P30304 1/20 0.44
TP53 P04637 2/20 0.43
MAPK1 P28482 1/20 0.43
CYP1A2 P05177 2/20 0.42
CYP2D6 P10635 2/20 0.42
HSD17B10 Q99714 2/20 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
SCHEMBL7169580 0.81 ALDH1A1 (0.41) GAAHPGDKDM1AALDH1A1KMT2A
SCHEMBL10968364 0.81 ALDH1A1 (0.45) GAAHPGDALDH1A1KMT2AKDM4E
SCHEMBL2287889 0.81 GAA (0.48) GAAHPGDALDH1A1KMT2AKDM4E
SCHEMBL12265301 0.79 CYP2D6 (0.66) GAAKDM1AALDH1A1KMT2AKDM4E
SCHEMBL23890049 0.79 ALDH1A1 (0.49) KDM1AALDH1A1KMT2AMEN1ALDH2
SCHEMBL15644072 0.79 ALDH1A1 (0.59) ALDH1A1KMT2AKDM4EMEN1ALDH2
SCHEMBL4571021 0.78 HTR2A (0.58) GAAALDH1A1KMT2AKDM4ESMN1; SMN2
SCHEMBL4571023 0.78 SMN1; SMN2 (0.40) GAAKDM1AALDH1A1KMT2AKDM4E
SCHEMBL8170132 0.78 SMN1; SMN2 (0.54) GAAALDH1A1KMT2AKDM4EMEN1
SCHEMBL8165960 0.78 SMN1; SMN2 (0.49) GAAALDH1A1KMT2AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6560004-B2 Coupled electrochromic compounds with photostable dication oxidation states GENTEX CORPORATION 2003-05-06 US disclosed
US-20020018281-A1 Coupled electrochromic compounds with photostable dication oxidation states THEISTE DAVID A (US) 2002-02-14 US disclosed
US-6249369-B1 Coupled electrochromic compounds with photostable dication oxidation states GENTEX CORPORATION 2001-06-19 US disclosed
EP-0066543-B1 THERMALLY POLYMERIZABLE COMPOSITIONS AND PROCESS FOR THE THERMAL POLYMERIZATION OF CATIONICALLY POLYMERIZABLE COMPOUNDS CIBA-GEIGY AG (CH) 1985-11-27 EP disclosed