SCHEMBL27684239

SCHEMBL27684239

CCCC(C(=O)O)c1cc(-c2ccccc2)cc(OCc2ccccc2)c1C(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 3/20 0.58
PSEN2 P49810 1/20 0.58
APH1B Q8WW43 1/20 0.58
NCSTN Q92542 1/20 0.58
APH1A Q96BI3 1/20 0.58
PSENEN Q9NZ42 1/20 0.58
PTPN1 P18031 7/20 0.44
PTPN6 P29350 5/20 0.44
PTPN2 P17706 4/20 0.44
KIFC1 Q9BW19 1/20 0.41
ALOX5 P09917 1/20 0.41
MRGPRX4 Q96LA9 2/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
PTGER1 P34995 1/20 0.39
PTGER4 P35408 1/20 0.39
PTGER3 P43115 1/20 0.39
PTGER2 P43116 1/20 0.39
MCL1 Q07820 1/20 0.39

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
SCHEMBL27684238 1.00 PSEN1 (0.58) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL27702994 1.00 PSEN1 (0.58) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL27684166 0.84 PSEN1 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL27703014 0.84 PTPN1 (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL27962194 0.81 PSEN1 (0.45) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL27793376 0.80 PTPN1 (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2896742 0.80 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2904116 0.79 PSEN1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3916035 0.79 PTPN1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3992666 0.76 PSEN1 (0.48) PSEN1PSEN2APH1BNCSTNAPH1A

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
CN-101084178-B (biphenyl) carboxylic acids and derivatives thereof CELLZOME AG 2012-03-28 CN claimed
CN-101084178-A (Biphenyl) carboxylic acids and derivatives thereof CELLZOME AG (DE) 2007-12-05 CN claimed
CN-101084178-B (biphenyl) carboxylic acids and derivatives thereof CELLZOME AG 2012-03-28 CN disclosed
CN-101084178-A (Biphenyl) carboxylic acids and derivatives thereof CELLZOME AG (DE) 2007-12-05 CN disclosed