SCHEMBL8546374

SCHEMBL8546374

N#Cc1ccc(Oc2cc(F)cc(Oc3ccc(C#N)cc3)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.51
FFAR4 Q5NUL3 1/20 0.51
PARP15 Q460N3 1/20 0.49
PARP10 Q53GL7 1/20 0.49
PARP2 Q9UGN5 1/20 0.49
CYP19A1 P11511 1/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
PKM P14618 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
IL18 Q14116 1/20 0.47
EPAS1 Q99814 13/20 0.43
HAO1 Q9UJM8 1/20 0.42
CHRM1 P11229 1/20 0.42
PDE4A P27815 1/20 0.42

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
SCHEMBL29582194 0.89 PARP15 (0.57) FFAR1FFAR4PARP15PARP10PARP2
SCHEMBL3138833 0.85 PARP15 (0.53) FFAR1FFAR4PARP15PARP10PARP2
SCHEMBL7074972 0.83 EPAS1 (0.44) FFAR1FFAR4EPAS1VEGFA
SCHEMBL921025 0.83 CYP19A1 (0.51) FFAR1FFAR4PARP15PARP10PARP2
SCHEMBL8852392 0.82 PARP15 (0.63) PARP15PARP10PARP2CYP19A1KDM4E
SCHEMBL7041250 0.82 PARP15 (0.63) PARP15PARP10PARP2CYP19A1KDM4E
SCHEMBL30689372 0.80 CYP19A1 (0.57) FFAR1FFAR4PARP15PARP10PARP2
SCHEMBL27368527 0.80 CYP19A1 (0.57) FFAR1FFAR4PARP15PARP10PARP2
SCHEMBL852039 0.80 MEN1 (0.53) PARP15PARP10PARP2CYP19A1KDM4E
SCHEMBL8546604 0.80 AR (0.51) PARP15PARP10PARP2CYP19A1KDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0696585-B1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMA CO LTD (JP) 1998-12-16 EP disclosed
US-5643931-A ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
EP-0696585-A1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-02-14 EP disclosed