SCHEMBL810000

SCHEMBL810000

C=Cc1cc(Cl)c(CCl)c2cc3ccccc3cc12

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30
MITF O75030 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
PKM P14618 1/20 0.30
MAPK1 P28482 1/20 0.30
RAB9A P51151 1/20 0.30
CCR6 P51684 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL809803 0.85 ALDH1A1 (0.44) L3MBTL1ALDH1A1CYP1A2
SCHEMBL2516586 0.84 L3MBTL1 (0.42) L3MBTL1ALDH1A1MAPTKMT2AMEN1
SCHEMBL809707 0.83 L3MBTL1 (0.41) L3MBTL1ALDH1A1MAPTCYP1A2RAB9A
SCHEMBL809749 0.83 L3MBTL1 (0.41) L3MBTL1ALDH1A1
SCHEMBL810002 0.80 L3MBTL1 (0.39) L3MBTL1ALDH1A1MAPTKMT2AMEN1
SCHEMBL809812 0.79 NQO1 (0.45) L3MBTL1ALDH1A1MAPTCYP1A2
SCHEMBL810262 0.77 L3MBTL1 (0.36) L3MBTL1ALDH1A1MAPTRAB9ACCR6
SCHEMBL809672 0.76 TLR8 (0.36) L3MBTL1CYP2C9
SCHEMBL809665 0.74 KMT2A (0.36) L3MBTL1ALDH1A1MAPTKMT2AMEN1
SCHEMBL809845 0.74 L3MBTL1 (0.40) L3MBTL1KMT2ACYP1A2CYP2C9

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