SCHEMBL10043787

SCHEMBL10043787

CC1(C)C2=C(CCC=C2)c2ccc(N)cc21

nearest known ligand 0.30

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ CASP1 P29466 1/20 0.30
▸ CASP7 P55210 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL20245386 0.88 — —
SCHEMBL13523460 0.82 TDP2 (0.30) —
SCHEMBL21546160 0.79 KDM4E (0.30) KDM4ENPC1ALDH1A1LMNAMAPT
SCHEMBL20734798 0.77 SMN1; SMN2 (0.41) KDM4ENPC1ALDH1A1LMNAMAPT
SCHEMBL20861015 0.77 KDM4E (0.34) KDM4ENPC1ALDH1A1LMNAMAPT
SCHEMBL13749723 0.77 PGR (0.30) —
SCHEMBL25644459 0.77 OPRM1 (0.32) KDM4ENPC1ALDH1A1LMNAMAPT
SCHEMBL12992911 0.76 — —
SCHEMBL16361148 0.76 KDM4E (0.30) KDM4ENPC1ALDH1A1LMNAMAPT
SCHEMBL20842902 0.75 PDK2 (0.39) KDM4EALDH1A1LMNAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012015265-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD (KR) 2012-02-02 — — WO disclosed
WO-2010147318-A2 AMINOANTHRACENE DERIVATIVE AND AN ORGANIC ELECTROLUMINESCENT ELEMENT EMPLOYING THE SAME 주식회사 두산 (KR) 2010-12-23 — — WO disclosed
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