SCHEMBL3416775

SCHEMBL3416775

COc1cc(Cl)cc(Cl)c1CCO

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
ERN1 O75460 1/20 0.39
P2RX7 Q99572 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
TLR8 Q9NR97 2/20 0.35
TNKS2 Q9H2K2 1/20 0.35
TTR P02766 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL4515598 0.85 ERN1 (0.41) KMT2AERN1P2RX7CYP2C9CYP1A2
SCHEMBL13574584 0.81 MAPT (0.36) ERN1P2RX7CYP1A2KDM4EMAPT
SCHEMBL1569756 0.81 TAAR1 (0.51) CYP1A2KDM4ETAAR1
SCHEMBL3415768 0.80 ALDH1A1 (0.43) KMT2AERN1CYP2C9CYP1A2CYP2D6
SCHEMBL2996061 0.79 TTR (0.44) KMT2AERN1P2RX7CYP1A2KDM4E
SCHEMBL15129491 0.77 TAAR1 (0.42) ERN1P2RX7MAPTTDP1TAAR1
SCHEMBL20595699 0.75 KDM4E (0.48) ERN1P2RX7KDM4ETDP1ALDH1A1
SCHEMBL20652725 0.74 TAAR1 (0.39) KMT2AERN1CYP2C9KDM4EMAPT
SCHEMBL3411051 0.74 L3MBTL1 (0.41) CYP1A2CYP2D6KDM4EMAPTTDP1
SCHEMBL7044311 0.73 HPGD (0.39) KMT2AERN1P2RX7CYP1A2KDM4E

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
EP-2265616-A1 FURO-AND THIENO[3,2-C]PYRIDINES OSI Pharmaceuticals, Inc. (US) 2010-12-29 EP disclosed
WO-2009100282-A1 FURO-AND THIENO[3,2-C] PYRIDINES OSI PHARMACEUTICALS, INC. (US) 2009-08-13 WO disclosed