SCHEMBL4068686

SCHEMBL4068686

COCCc1nc(O)cc(O)n1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.40
CHRM2 P08172 2/20 0.32
CHRM4 P08173 2/20 0.32
CHRM5 P08912 2/20 0.32
CHRM1 P11229 2/20 0.32
CHRM3 P20309 2/20 0.32
TSHR P16473 1/20 0.31
CACNA1H O95180 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
SCHEMBL2117301 0.77 PRKCE (0.38) HCAR2
SCHEMBL13727646 0.76 HCAR2 (0.33) HCAR2
SCHEMBL10429473 0.75 GPR84 (0.39) HCAR2
SCHEMBL4273865 0.72 KDM4E (0.34)
SCHEMBL10429469 0.71 GPR84 (0.44) HCAR2
SCHEMBL11581688 0.71 HCAR2 (0.35) HCAR2
SCHEMBL2115423 0.70
SCHEMBL2118423 0.70
SCHEMBL7940988 0.70 GPR84 (0.51) CHRM2CHRM5CHRM1CHRM3TSHR
SCHEMBL10004688 0.69 GPR84 (0.34) HCAR2TSHR

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
CN-101646657-A Process for producing trichloropyrimidine compound SUMITOMO CHEMICAL CO JP 2010-02-10 CN disclosed
EP-2128141-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND Sumitomo Chemical Company, Limited (JP) 2009-12-02 EP disclosed