SCHEMBL5592840

SCHEMBL5592840

CN1CCN(C(=O)c2ccc(CNC(=O)O)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
NAMPT P43490 1/20 0.60
POLB P06746 4/20 0.59
HRH3 Q9Y5N1 2/20 0.58
MAPK10 P53779 1/20 0.57
HPGD P15428 3/20 0.54
ALOX15 P16050 1/20 0.54
GRM5 P41594 1/20 0.54
NPC1 O15118 1/20 0.53
HSD11B1 P28845 1/20 0.53
LMNA P02545 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
CHKA P35790 1/20 0.52
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C19 P33261 1/20 0.51
EPHX2 P34913 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.50

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
SCHEMBL2377995 0.85 HRH3 (0.61) KMT2AMEN1NAMPTPOLBHRH3
SCHEMBL20394941 0.85 POLB (0.61) NAMPTPOLBMAPK10HPGDALOX15
SCHEMBL21015832 0.85 HPGD (0.57) KMT2AMEN1NAMPTPOLBHRH3
SCHEMBL19634454 0.83 KMT2A (0.67) KMT2AMEN1NAMPTPOLBHRH3
SCHEMBL1695943 0.82 HRH3 (0.55) KMT2AMEN1NAMPTPOLBHRH3
SCHEMBL2378092 0.81 NAMPT (0.54) KMT2AMEN1NAMPTPOLBHRH3
SCHEMBL10724841 0.80 POLB (0.81) KMT2AMEN1POLBHRH3HPGD
SCHEMBL3754883 0.80 HRH3 (0.66) KMT2AMEN1POLBHRH3HPGD
SCHEMBL11955563 0.80 HRH3 (0.66) KMT2AMEN1POLBHRH3HPGD
SCHEMBL20399607 0.79 LTB4R2 (0.60) KMT2AMEN1NAMPTPOLBHRH3

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-2007017728-A2 NOVEL HETEROCYCLIC COMPOUNDS ORCHID RESEARCH LABORATORIES LIMITED (IN) 2007-02-15 WO claimed