SCHEMBL4051982

SCHEMBL4051982

Fc1cnc2c(CBr)n[nH]c2c1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 7/20 0.39
DYRK1A Q13627 1/20 0.38
TRPA1 O75762 5/20 0.34
KDM4E B2RXH2 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL16680836 0.73 DYRK1A (0.62) GRM4DYRK1ATRPA1KDM4ERAB9A
SCHEMBL23695333 0.71 AGBL2 (0.39)
SCHEMBL29738172 0.71 AGBL2 (0.39)
Bromide SCHEMBL25373037 0.70 AGBL2 (0.38)
SCHEMBL25468794 0.69 GRM4 (0.39) GRM4DYRK1ATRPA1KDM4ERAB9A
SCHEMBL20901588 0.69 GRM4 (0.50) GRM4TRPA1
SCHEMBL23500869 0.66 AGBL2 (0.38)
SCHEMBL30270583 0.66 AGBL2 (0.38)
SCHEMBL30569315 0.64 AGBL2 (0.37)
SCHEMBL23530950 0.64 AGBL2 (0.37)

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
WO-2009117278-A2 PROCESSES FOR PREPARING (AMINO-PYRAZOLOPYRIDINYL)METHOXY SUBSTITUTED BIARYL ETHERS MERCK & CO., INC. (US) 2009-09-24 WO disclosed