SCHEMBL17536905

SCHEMBL17536905

Cc1ccc(-c2ccccc2-c2cccc(-c3ccc4c5ccccc5c5ccc(-c6cccc(-c7ccccc7-c7ccc(C)cc7)c6)cc5c4c3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP3 O14638 1/20 0.39
▸ MAOB P27338 2/20 0.38
▸ HPRT1 P00492 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ CRHR1 P34998 1/20 0.38
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ NTSR1 P30989 1/20 0.37
▸ ENPP1 P22413 1/20 0.37
▸ PDCD1 Q15116 1/20 0.37
▸ CD274 Q9NZQ7 1/20 0.37
▸ PTPN5 P54829 1/20 0.36
▸ GPR84 Q9NQS5 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ ACHE P22303 1/20 0.36
▸ DHODH Q02127 1/20 0.36
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 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
SCHEMBL17536904 0.89 PTPN5 (0.44) MAOBHPRT1ALDH1A1MAPTNPC1
SCHEMBL20152244 0.88 ALOX5 (0.43) ENPP3MAOBHPRT1ALDH1A1MAPT
SCHEMBL22978749 0.82 MAOB (0.46) MAOBALDH1A1RAB9APTPN5MEN1
SCHEMBL17536903 0.82 KDM4E (0.45) ENPP3ALDH1A1ENPP1CA12CA1
SCHEMBL10611285 0.81 APP (0.41) ALDH1A1MAPTNPC1RAB9AMEN1
SCHEMBL311659 0.80 ESR1 (0.46) HPRT1MEN1KMT2ACA12CA2
SCHEMBL311937 0.80 ESR1 (0.46) HPRT1MEN1KMT2ACA12CA2
SCHEMBL25668986 0.79 MAP4K4 (0.46) ENPP3ALDH1A1NPC1RAB9APTPN5
SCHEMBL20152282 0.79 CYP1A1 (0.46) ALDH1A1MAPTNPC1RAB9ANTSR1
SCHEMBL17536906 0.79 KDM4E (0.45) HPRT1MAPTNPC1RAB9APDCD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9944846-B2 Compositions for electronic applications E I DU PONT DE NEMOURS AND COMPANY (US) 2018-04-17 — — US disclosed
US-20160060512-A1 COMPOSITIONS FOR ELECTRONIC APPLICATIONS LG CHEM, LTD. (KR) 2016-03-03 — — US disclosed
WO-2016033167-A1 COMPOSITIONS FOR ELECTRONIC APPLICATIONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2016-03-03 — — WO disclosed
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