SCHEMBL16489384

SCHEMBL16489384

CC(C)(C)c1c2ccccc2c(-c2cccc3ccccc23)c2ccc(-c3cc([Si](C)(C)C)cc([Si](C)(C)C)c3)cc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 3/20 0.35
▸ PPARA Q07869 3/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ PPARD Q03181 1/20 0.35
▸ ENPP3 O14638 1/20 0.34
▸ ENPP1 P22413 1/20 0.34
▸ KCNQ3 O43525 1/20 0.34
▸ KCNQ2 O43526 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ DHFR P00374 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ATM Q13315 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ CA12 O43570 3/20 0.32
▸ CA1 P00915 3/20 0.32
▸ CA2 P00918 3/20 0.32
▸ CA9 Q16790 3/20 0.32

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
SCHEMBL20877893 0.84 PPARG (0.39) PPARGPPARACYP2C19CYP2C9PPARD
SCHEMBL16489383 0.80 STK10 (0.35) PPARGPPARACYP2C19CYP2C9PPARD
SCHEMBL16489391 0.76 DHFR (0.41) KCNQ3KCNQ2ALDH1A1DHFRKDM4E
SCHEMBL16489389 0.76 KCNQ3 (0.36) PPARGPPARACYP2C19CYP2C9PPARD
SCHEMBL2955115 0.74 CA12 (0.45) CYP2C19ENPP3ENPP1ALDH1A1DHFR
SCHEMBL13697060 0.74 ENPP3 (0.38) PPARGPPARACYP2C19CYP2C9PPARD
SCHEMBL4084177 0.73 DHFR (0.43) ENPP3ENPP1KCNQ3KCNQ2ALDH1A1
SCHEMBL4079264 0.73 DHFR (0.43) ENPP3ENPP1KCNQ3KCNQ2ALDH1A1
SCHEMBL23789788 0.73 CA12 (0.43) PPARGPPARACYP2C19CYP2C9PPARD
SCHEMBL19654596 0.72 CA12 (0.37) CYP2C19ENPP3ENPP1ALDH1A1DHFR

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
US-20150048321-A1 ANTHRACENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-02-19 — — US disclosed
US-20150048321-A1 ANTHRACENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-02-19 — — US disclosed
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