SCHEMBL12924259

SCHEMBL12924259

CCCCOCCCc1cc2c(s1)-c1ccc3c4c(ccc-2c14)-c1ccccc1-3

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.34
▸ CYP19A1 P11511 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ ALDH1A1 P00352 4/20 0.32
▸ TSHR P16473 3/20 0.32
▸ PDK2 Q15119 3/20 0.32
▸ PTPN11 Q06124 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ HRH3 Q9Y5N1 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ KDM4E B2RXH2 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
SCHEMBL12924371 0.89 LMNA (0.30) LMNAMAPK1
SCHEMBL12924201 0.89 LMNA (0.37) CYP1A2CYP19A1CYP2C9CYP2C19LMNA
SCHEMBL12924345 0.85 LMNA (0.31) LMNAMAPK1
SCHEMBL12924323 0.85 LMNA (0.32) ALDH1A1TSHRCYP3A4LMNAMAPK1
SCHEMBL12924299 0.83 LMNA (0.40) ALDH1A1TSHRHPGDLMNAMAPK1
SCHEMBL12924291 0.80 MAPK14 (0.30) —
SCHEMBL12924373 0.79 — —
SCHEMBL12924356 0.78 — —
SCHEMBL12924265 0.77 NPC1 (0.33) LMNA
SCHEMBL12924328 0.74 HSD17B1 (0.35) ALDH1A1HPGDLMNAMAPK1KDM4E

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-8294144-B2 Organic transistor YAMAMOTO CHEMICALS, INC. (JP) 2012-10-23 — — US disclosed
US-20110012098-A1 ORGANIC TRANSISTOR YAMAMOTO CHEMICALS, INC. (JP) 2011-01-20 — — US disclosed
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