SCHEMBL14500801

SCHEMBL14500801

COc1cc(C)cc(-c2nc3ccc(OC)cc3cc2C)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.45
▸ ALDH1A1 P00352 6/20 0.45
▸ HPGD P15428 4/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ MAPT P10636 2/20 0.45
▸ TP53 P04637 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ RAB9A P51151 3/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ NCF1 P14598 1/20 0.44
▸ HSD17B1 P14061 1/20 0.44
▸ HSD17B2 P37059 1/20 0.44
▸ PDE3B Q13370 2/20 0.43

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
SCHEMBL13870833 0.94 KDM4E (0.47) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL14500817 0.90 RAB9A (0.43) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL14528745 0.85 KDM4E (0.40) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL14500800 0.84 PDE10A (0.47) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL13647188 0.83 ALDH1A1 (0.43) KDM4EALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL28539187 0.81 PDE10A (0.65) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL14500804 0.79 MEN1 (0.45) KDM4EALDH1A1HPGDSMN1; SMN2TP53
SCHEMBL12969963 0.79 PDK1 (0.54) KDM4EMAPTTP53CYP11B1CYP11B2
SCHEMBL14500806 0.78 KDM4E (0.47) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL13870830 0.78 KDM4E (0.42) KDM4EALDH1A1HPGDSMN1; SMN2MAPT

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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