SCHEMBL14500802

SCHEMBL14500802

COc1ccc2nc(-c3ccc(C)cc3C)c(C)cc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.48
▸ ALDH1A1 P00352 4/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ HPGD P15428 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ NCF1 P14598 1/20 0.44
▸ CYP11B1 P15538 4/20 0.43
▸ CYP11B2 P19099 4/20 0.43
▸ NQO1 P15559 1/20 0.42
▸ EGFR P00533 1/20 0.41
▸ PDGFRB P09619 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
SCHEMBL14500818 0.90 CYP11B1 (0.43) KDM4EALDH1A1SMN1; SMN2TP53NCF1
SCHEMBL14500811 0.86 KDM4E (0.44) KDM4EALDH1A1SMN1; SMN2HPGDTP53
SCHEMBL14500748 0.81 NCF1 (0.50) KDM4EALDH1A1SMN1; SMN2MAPTNCF1
SCHEMBL14528741 0.80 PDGFRB (0.43) KDM4EALDH1A1SMN1; SMN2HPGDTSHR
SCHEMBL13870833 0.78 KDM4E (0.47) KDM4EALDH1A1SMN1; SMN2HPGDTP53
SCHEMBL14500800 0.78 PDE10A (0.47) KDM4EALDH1A1SMN1; SMN2HPGDTP53
SCHEMBL13647133 0.77 CYP1A2 (0.47) KDM4EALDH1A1SMN1; SMN2HPGDMAPT
SCHEMBL14500801 0.76 KDM4E (0.45) KDM4EALDH1A1SMN1; SMN2HPGDTP53
SCHEMBL14537843 0.76 GSTP1 (0.61) CYP3A4CYP2D6CYP2C9CYP2C19CYP11B1
SCHEMBL13647156 0.75 ALDH1A1 (0.46) KDM4EALDH1A1SMN1; SMN2HPGDTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9023489-B2 Red phosphorescent compounds and organic electroluminescent devices using the same LG DISPLAY CO., LTD. (KR) 2015-05-05 — — US disclosed
US-9023489-B2 Red phosphorescent compounds and organic electroluminescent devices using the same LG DISPLAY CO., LTD. (KR) 2015-05-05 — — US disclosed
US-20070104980-A1 Red phosphorescent compounds and organic electroluminescent devices using the same LG DISPLAY CO., LTD. (KR) 2007-05-10 — — US disclosed
US-20070104980-A1 Red phosphorescent compounds and organic electroluminescent devices using the same LG DISPLAY CO., LTD. (KR) 2007-05-10 — — US disclosed
EP-1783132-A1 Red phosphorescent compounds and organic electromuninescent devices using the same LG Electronics Inc. (KR) 2007-05-09 — — EP disclosed
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