SCHEMBL14624152

SCHEMBL14624152

CCCc1ccc2c(O)cc(C3=CCCC=C3)nc2c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
ALOX5 P09917 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
SCHEMBL14623161 0.77 MYC (0.37) MEN1POLBKMT2A
SCHEMBL24696102 0.71 NOS3 (0.30) CNR1CNR2
SCHEMBL14035489 0.68 DHODH (0.56)
SCHEMBL18807848 0.67 NISCH (0.39) CNR1CNR2MEN1KMT2AALOX5
SCHEMBL14727986 0.65 TRPM4 (0.33)
SCHEMBL14231832 0.64 KDM4E (0.56) MEN1GAAKMT2A
SCHEMBL6860905 0.63 TRPA1 (0.46) CNR1CNR2MEN1POLBGAA
SCHEMBL12463923 0.61 ELANE (0.41) MEN1POLBGAAKMT2A
SCHEMBL2399470 0.59 CNR1 (0.48) CNR1CNR2MEN1POLBGAA
SCHEMBL5541764 0.59 HSD17B10 (0.49) CNR1CNR2MEN1GAAKMT2A

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-2007001406-A2 ARYL-CONTAINING MACROCYCLIC COMPOUNDS CHIRON CORPORATION (US) 2007-01-04 WO disclosed