SCHEMBL9766719

SCHEMBL9766719

CCCC1CCC(C(C)c2ccc(-c3ccc(F)nc3F)cc2)CC1.CCCCC1CCC(C(C)c2ccc(-c3ccc(F)nc3F)cc2)CC1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
APLNR P35414 4/20 0.33
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL9250333 0.98 APLNR (0.34) APLNRMEN1GAAMAPK1KMT2A
SCHEMBL9249912 0.95 APLNR (0.32) APLNR
SCHEMBL9244209 0.94 GAA (0.34) APLNRGAA
SCHEMBL9250236 0.93 GAA (0.36) APLNRGAA
SCHEMBL9766630 0.90 MEN1 (0.30) MEN1GAAMAPK1KMT2A
SCHEMBL9159148 0.89 MEN1 (0.31) MEN1GAAMAPK1KMT2A
SCHEMBL9253040 0.86 TRPV3 (0.33) APLNR
SCHEMBL9154681 0.86 GAA (0.33) GAA
SCHEMBL9159896 0.85 SLC6A2 (0.31)
SCHEMBL8774099 0.83 GAA (0.31) MEN1GAAMAPK1KMT2A

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-0445248-A1 PYRIDINE DERIVATIVES. MERCK PATENT GMBH (DE) 1991-09-11 EP disclosed