SCHEMBL810291

SCHEMBL810291

C=Cc1ccc(CCl)c2cc3c(C)cccc3cc12

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CYP2A6 P11509 2/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL809771 0.84 ALDH1A1 (0.36) CYP1A2ALDH1A1CYP2A6L3MBTL1
SCHEMBL810223 0.83 L3MBTL1 (0.30) L3MBTL1
SCHEMBL809953 0.83 KDM4E (0.38) CYP1A2ALDH1A1HPGDHSD17B10L3MBTL1
SCHEMBL810046 0.78 MAPT (0.35) ALDH1A1HPGDL3MBTL1
SCHEMBL809732 0.73 KMT2A (0.38) ALDH1A1
SCHEMBL9049792 0.70 ALDH1A1 (0.39) ALDH1A1L3MBTL1
SCHEMBL598230 0.69 CYP1A2 (0.65) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6
SCHEMBL808751 0.68 ALDH1A1 (0.33) CYP1A2ALDH1A1HPGDCYP2A6
SCHEMBL809707 0.68 L3MBTL1 (0.41) CYP1A2ALDH1A1CYP2A6L3MBTL1
SCHEMBL10560099 0.67 CYP1A2 (0.62) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012015977-A3 HIGHLY PORTABLE AND STABLE WORK STATION HERSCHLER MATTHEW B (US) 2012-05-10 WO disclosed
EP-2192645-B1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME TOKUYAMA CORP (JP) 2011-11-30 EP disclosed
US-20110250525-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME TOKUYAMA CORPORATION (JP) 2011-10-13 US disclosed
EP-2192645-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME Tokuyama Corporation (JP) 2010-06-02 EP disclosed