SCHEMBL7963174

SCHEMBL7963174

NC(=O)c1c(C(F)(F)F)c(-c2cccnc2)n2c1C=CCC2

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 8/20 0.37
MKNK2 Q9HBH9 8/20 0.37
CSNK1D P48730 1/20 0.37
CSNK1E P49674 1/20 0.37
P2RX7 Q99572 2/20 0.35
SCN9A Q15858 1/20 0.35
CYP11B2 P19099 4/20 0.34
EGFR P00533 1/20 0.33
FGFR1 P11362 1/20 0.33
KDR P35968 1/20 0.33
ERN1 O75460 1/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
CFTR P13569 1/20 0.33

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
SCHEMBL8327305 0.90 MKNK1 (0.36) MKNK1MKNK2P2RX7CYP11B2EGFR
SCHEMBL7967982 0.89 CYP11B2 (0.37) MKNK1MKNK2P2RX7CYP11B2EGFR
SCHEMBL7965769 0.87 CFTR (0.41) CYP11B2CFTR
SCHEMBL7965530 0.84 MKNK1 (0.40) MKNK1MKNK2CSNK1DCSNK1ECYP11B2
SCHEMBL2158254 0.84 MKNK1 (0.43) MKNK1MKNK2CSNK1DCSNK1EP2RX7
SCHEMBL7965727 0.82 MKNK1 (0.38) MKNK1MKNK2CSNK1DCSNK1ESCN9A
SCHEMBL7962850 0.81 MKNK1 (0.41) MKNK1MKNK2CSNK1DCSNK1ECYP11B2
SCHEMBL7953686 0.79 POLB (0.31)
SCHEMBL7962090 0.79 CYP11B2 (0.39) CYP11B2
SCHEMBL7955168 0.77 CSNK1D (0.39) MKNK1MKNK2CSNK1DCSNK1EP2RX7

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
US-6207675-B1 FOR PROPHYLAXIS AND THERAPY OF DISEASES IN WHICH ARE INVOLVED VIRUSES OF THE HERPES FAMILY AND/OR CYTOKINES IN PARTICULAR TUMOR NERCOSIS FACTOR-ALPHA RHONE-POULENC RORER S.A. (FR) 2001-03-27 US claimed
US-6207675-B1 FOR PROPHYLAXIS AND THERAPY OF DISEASES IN WHICH ARE INVOLVED VIRUSES OF THE HERPES FAMILY AND/OR CYTOKINES IN PARTICULAR TUMOR NERCOSIS FACTOR-ALPHA RHONE-POULENC RORER S.A. (FR) 2001-03-27 US disclosed