SCHEMBL9718236

SCHEMBL9718236

O=C(c1ccc(O)c2ccccc12)c1ccc(F)c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.50
CNR2 P34972 4/20 0.50
IDO1 P14902 2/20 0.48
CXCR5 P32302 1/20 0.43
KDM4E B2RXH2 1/20 0.41
MPI P34949 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HDAC3 O15379 1/20 0.39
EP300 Q09472 1/20 0.39
KAT2B Q92831 1/20 0.39
KAT8 Q9H7Z6 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
CDC25B P30305 2/20 0.39
LDHA P00338 1/20 0.39
CTSB P07858 2/20 0.38
THRB P10828 1/20 0.38
CAPN1 P07384 1/20 0.38
CTSL P07711 1/20 0.38
PRNP P04156 1/20 0.38

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
SCHEMBL31540836 0.84 IDO1 (0.68) IDO1KDM4EMPIL3MBTL1HDAC3
SCHEMBL484933 0.84 IDO1 (0.68) IDO1KDM4EMPIL3MBTL1HDAC3
SCHEMBL29388776 0.84 IDO1 (0.68) IDO1KDM4EMPIL3MBTL1HDAC3
SCHEMBL247300 0.78 CDC25B (0.62) CNR1CNR2L3MBTL1EP300CDC25B
SCHEMBL7915213 0.77 GAA (0.56) IDO1KDM4E
SCHEMBL10385522 0.76 MAPT (0.49) CNR1CNR2CXCR5KDM4E
SCHEMBL249578 0.76 NR4A1 (0.52) CNR1CNR2CXCR5KDM4ECDC25B
SCHEMBL7228081 0.76 CDC25B (0.50) CNR2IDO1KDM4ECDC25BTHRB
SCHEMBL4031210 0.75 ALDH1A1 (0.57) CNR1CNR2CXCR5
SCHEMBL401068 0.75 CNR1 (0.47) CNR1CNR2CXCR5KDM4EL3MBTL1

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
US-5091480-A Comb-like polymers and graft copolymers from polyarylene polyether macromonomers THE B. F. GOODRICH COMPANY (US) 1992-02-25 US disclosed