SCHEMBL27898703

SCHEMBL27898703

Fc1cc(F)c([CH]CCl)c(F)c1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.33
PTP4A3 O75365 1/20 0.32
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
GPR84 Q9NQS5 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
SCHEMBL10584765 0.79 CA1 (0.34)
SCHEMBL18242209 0.78 ERN1 (0.33) ERN1PTP4A3CES2CES1GPR84
SCHEMBL2091124 0.73 ERN1 (0.37) ERN1PTP4A3CES2CES1
SCHEMBL17514757 0.72 PTP4A3 (0.33) ERN1PTP4A3
SCHEMBL18378562 0.72 ERN1 (0.30) ERN1PTP4A3
SCHEMBL2076815 0.69 CNR1 (0.33) ERN1CES2CES1GPR84
SCHEMBL320358 0.69 ERN1 (0.34) ERN1PTP4A3CES2CES1
SCHEMBL95723 0.69 ERN1 (0.50) ERN1PTP4A3CES2CES1
SCHEMBL1547843 0.69 ERN1 (0.34) ERN1PTP4A3CES2CES1
SCHEMBL19439647 0.67 CA12 (0.36) ERN1PTP4A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103038231-A Modulators of HEC1 activity and methods thereof TAIVEX THERAPEUTICS INC 2013-04-10 CN disclosed