SCHEMBL4319665

SCHEMBL4319665

CN(CCc1ccccc1)C(=O)CCc1ccc(O)cc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.64
LTB4R Q15722 8/20 0.57
LTB4R2 Q9NPC1 8/20 0.57
OPRM1 P35372 2/20 0.56
OPRD1 P41143 2/20 0.56
OPRK1 P41145 2/20 0.56
KDM4E B2RXH2 1/20 0.52
RAB9A P51151 3/20 0.51
NPC1 O15118 2/20 0.51
ALOX5 P09917 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MEN1 O00255 1/20 0.49
ESRRG P62508 1/20 0.49

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
SCHEMBL14219225 0.92 KMT2A (0.74) KMT2ALTB4RLTB4R2RAB9ANPC1
SCHEMBL13869716 0.88 KMT2A (0.84) KMT2ARAB9ANPC1L3MBTL1MEN1
SCHEMBL8506886 0.82 KMT2A (0.57) KMT2ALTB4RLTB4R2RAB9ANPC1
SCHEMBL12017300 0.82 KMT2A (0.60) KMT2ALTB4RLTB4R2RAB9ANPC1
SCHEMBL8188967 0.82 KMT2A (0.70) KMT2ALTB4RLTB4R2RAB9ANPC1
SCHEMBL24095946 0.81 ESRRG (0.49) KMT2ALTB4RLTB4R2OPRM1OPRD1
SCHEMBL17117230 0.81 ALOX5 (0.71) KMT2ALTB4RLTB4R2RAB9ANPC1
SCHEMBL3959606 0.80 KMT2A (0.55) KMT2ALTB4RLTB4R2OPRM1OPRD1
SCHEMBL12133485 0.80 LTB4R (0.58) KMT2ALTB4RLTB4R2RAB9ANPC1
SCHEMBL4324200 0.80 KMT2A (0.46) KMT2AOPRM1OPRD1OPRK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009147221-A1 SMALL MOLECULE LEPTIN RECEPTOR MODULATORS BIOVITRUM AB (PUBL) (SE) 2009-12-10 WO claimed
WO-2009147221-A1 SMALL MOLECULE LEPTIN RECEPTOR MODULATORS BIOVITRUM AB (PUBL) (SE) 2009-12-10 WO disclosed