SCHEMBL24050461

SCHEMBL24050461

CC(C)C(F)c1cn[nH]c1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.39
LMNA P02545 1/20 0.38
APEX1 P27695 1/20 0.38
PMP22 Q01453 1/20 0.38
NOS2 P35228 1/20 0.33
AKT1 P31749 2/20 0.32
AKT2 P31751 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
SCHEMBL29236096 0.82 KCNH2 (0.37) KCNH2LMNAAPEX1PMP22AKT1
SCHEMBL23031949 0.77 KCNH2 (0.42) KCNH2LMNAAPEX1PMP22NOS2
SCHEMBL18291459 0.77 KCNH2 (0.42) KCNH2LMNAAPEX1PMP22NOS2
SCHEMBL8593149 0.77
SCHEMBL84454 0.77
Hydrochloric Acid SCHEMBL20897673 0.75
SCHEMBL6344963 0.75
SCHEMBL17824705 0.74 KCNH2 (0.39) KCNH2LMNAAPEX1PMP22NOS2
SCHEMBL20348834 0.74 KCNH2 (0.39) KCNH2LMNAAPEX1PMP22NOS2
SCHEMBL14157259 0.74 KCNH2 (0.39) KCNH2LMNAAPEX1PMP22NOS2

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
WO-2021237121-A1 SUBSTITUTED PYRIDINES GOSSAMER BIO SERVICES, INC. (US) 2021-11-25 WO disclosed