SCHEMBL21787707

SCHEMBL21787707

Cc1ccc2c(N)c(Cc3ccc4nc(C)ccc4c3N)ccc2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 2/20 0.43
CASP6 P55212 1/20 0.43
ALDH1A1 P00352 6/20 0.40
CASP1 P29466 2/20 0.38
CASP7 P55210 2/20 0.38
HSD17B10 Q99714 2/20 0.38
NCF1 P14598 1/20 0.38
CYP1A2 P05177 3/20 0.37
GAA P10253 2/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
NQO2 P16083 2/20 0.36
HPGD P15428 2/20 0.36
GLA P06280 1/20 0.36
CHRM2 P08172 1/20 0.36
ADRA2A P08913 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
CHRM1 P11229 1/20 0.36

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
SCHEMBL564343 0.79 ALDH1A1 (0.51) KDM4ELMNAPOLBCASP6ALDH1A1
SCHEMBL7455519 0.79 KDM4E (0.47) KDM4ELMNAPOLBCASP6ALDH1A1
SCHEMBL564237 0.76 KDM4E (0.44) KDM4ELMNAPOLBCASP6ALDH1A1
SCHEMBL564769 0.76 LMNA (0.46) KDM4ELMNAPOLBCASP6ALDH1A1
SCHEMBL8571925 0.75 ALDH1A1 (0.53) KDM4ELMNAPOLBCASP6ALDH1A1
SCHEMBL6518079 0.75 KDM4E (0.47) KDM4ELMNAPOLBCASP6ALDH1A1
SCHEMBL4659301 0.72 KDM4E (0.44) KDM4ELMNAPOLBCASP6ALDH1A1
SCHEMBL12130369 0.71 ALDH1A1 (0.38) KDM4ELMNAPOLBCASP6ALDH1A1
SCHEMBL16915062 0.71 GABRP (0.47) KDM4ELMNAPOLBCASP6ALDH1A1
SCHEMBL21787672 0.71 ALDH1A1 (0.69) LMNAPOLBALDH1A1GAAKMT2A

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-11186720-B2 Quinophthalone compound DIC CORPORATION (JP) 2021-11-30 US disclosed
WO-2021117410-A1 QUINOPHTHALONE COMPOUND, PIGMENT COMPOSITION, AND COLOR FILTER DIC株式会社 2021-06-17 WO disclosed
WO-2020045197-A1 PIGMENT COMPOSITION, COLORING COMPOSITION AND COLOR FILTER DIC株式会社 2020-03-05 WO disclosed
WO-2020045200-A1 ALKYLENE COMPOUND, QUINOPHTHALONE COMPOUND, AND QUINOPHTHALONE MIXTURE DIC株式会社 2020-03-05 WO disclosed