SCHEMBL16200397

SCHEMBL16200397

CCn1nc(CNC(=O)NC)c(Cl)c1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
RECQL P46063 1/20 0.33
ACSS2 Q9NR19 1/20 0.32
NR3C1 P04150 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.30
NOTUM Q6P988 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
SCHEMBL13066183 0.81 TRPV1 (0.31)
SCHEMBL13066184 0.75 PTGS2 (0.33)
SCHEMBL14039564 0.75 MAPK8 (0.36) KDM4E
SCHEMBL13715582 0.74 TRPC3 (0.33) KDM4ERECQL
SCHEMBL14039775 0.70 KDM4E (0.42) KDM4ERECQLTDP1
SCHEMBL13066243 0.69 KDM4E (0.41) KDM4ERECQLTDP1NOTUM
SCHEMBL14039578 0.68 P2RX7 (0.35) KDM4ERECQLNR3C1
SCHEMBL14015667 0.68 KDM4E (0.37) KDM4ERECQLTDP1
SCHEMBL16200214 0.67 ADORA2A (0.40) KDM4ERECQL
SCHEMBL13715717 0.66 CYP2C9 (0.34) KDM4ERECQL

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
EP-1720545-B1 BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES CHEMOCENTRYX INC (US) 2014-10-29 EP disclosed