SCHEMBL7962136

SCHEMBL7962136

N#Cc1c(C(F)(F)F)c(-c2cccnc2F)n2c1C(O)CCC2

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 2/20 0.35
ABL1 P00519 2/20 0.33
DPP4 P27487 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP11B2 P19099 1/20 0.32
AR P10275 1/20 0.30
LMNA P02545 1/20 0.30
PDK2 Q15119 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
SCHEMBL7965321 0.89 KCNMA1 (0.34) KCNMA1DPP4KDM4E
SCHEMBL7961767 0.88 KCNMA1 (0.38) KCNMA1ABL1KDM4ECYP11B2
SCHEMBL7953127 0.85 KCNMA1 (0.36) KCNMA1ABL1CYP11B2
SCHEMBL7962392 0.85 CYP11B2 (0.37) KCNMA1ABL1CYP11B2
SCHEMBL7965300 0.85 KCNMA1 (0.34) KCNMA1ABL1CYP11B2
SCHEMBL7965403 0.83 HCRTR1 (0.34) ABL1
SCHEMBL8327360 0.82 DHODH (0.35) ABL1
SCHEMBL7961681 0.81 CYP11B2 (0.37) KDM4ECYP11B2AR
SCHEMBL8327934 0.81 DHODH (0.35) KCNMA1ABL1KDM4ECYP11B2
SCHEMBL7962948 0.81 PLAU (0.35) ABL1KDM4ELMNAPDK2

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