SCHEMBL7961767

SCHEMBL7961767

N#Cc1c(C#N)c2n(c1-c1cccnc1F)CCCC2O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 5/20 0.38
CYP11B2 P19099 2/20 0.34
PDE4B Q07343 3/20 0.32
PDE4D Q08499 1/20 0.32
ABL1 P00519 2/20 0.31
PDE4A P27815 2/20 0.31
CYP11B1 P15538 1/20 0.31
LRRK2 Q5S007 1/20 0.31
CHRNB2 P17787 1/20 0.30
CHRNA6 Q15825 1/20 0.30
KDM4E B2RXH2 1/20 0.30
RECQL P46063 1/20 0.30
CSNK1A1 P48729 1/20 0.30
CSNK1D P48730 1/20 0.30
GSK3B P49841 1/20 0.30
CSNK1G2 P78368 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
SCHEMBL7962392 0.90 CYP11B2 (0.37) KCNMA1CYP11B2PDE4BPDE4DABL1
SCHEMBL7953127 0.90 KCNMA1 (0.36) KCNMA1CYP11B2PDE4BPDE4DABL1
SCHEMBL7962136 0.88 KCNMA1 (0.35) KCNMA1CYP11B2ABL1KDM4E
SCHEMBL7965300 0.87 KCNMA1 (0.34) KCNMA1CYP11B2PDE4BPDE4DABL1
SCHEMBL8327934 0.87 DHODH (0.35) KCNMA1CYP11B2PDE4BPDE4DABL1
SCHEMBL7961440 0.87 KDM4E (0.35) KCNMA1CYP11B2PDE4BPDE4DABL1
SCHEMBL7963132 0.87 PDE4B (0.34) KCNMA1CYP11B2PDE4BPDE4DABL1
SCHEMBL7961452 0.86 KCNMA1 (0.38) KCNMA1PDE4AKDM4ERECQL
SCHEMBL7962855 0.84 HCRTR1 (0.37) KCNMA1PDE4BPDE4DABL1
SCHEMBL8331687 0.79 CYP11B2 (0.41) KCNMA1CYP11B2PDE4BPDE4DPDE4A

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