SCHEMBL8370583

SCHEMBL8370583

NC(O)CCN1CCNCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.44
ERAP2 Q6P179 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
POLB P06746 1/20 0.42
HSD17B10 Q99714 1/20 0.41
CXCR4 P61073 2/20 0.41
SIGMAR1 Q99720 4/20 0.35
CHRM5 P08912 2/20 0.35
CHRM3 P20309 2/20 0.35
RAD52 P43351 2/20 0.35
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM1 P11229 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
RECQL P46063 1/20 0.33
LTA4H P09960 1/20 0.33
PADI1 Q9ULC6 1/20 0.32
PADI4 Q9UM07 1/20 0.32

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
SCHEMBL22664061 0.88 CXCR4 (0.47) ANPEPERAP2SMN1; SMN2POLBHSD17B10
SCHEMBL1408746 0.82 SMN1; SMN2 (0.45) ANPEPERAP2SMN1; SMN2POLBHSD17B10
SCHEMBL1469940 0.82 POLB (0.45) ANPEPERAP2SMN1; SMN2POLBHSD17B10
SCHEMBL9801548 0.80 SMN1; SMN2 (0.46) ANPEPERAP2SMN1; SMN2POLBHSD17B10
SCHEMBL22320733 0.80 SMN1; SMN2 (0.46) ANPEPERAP2SMN1; SMN2POLBHSD17B10
SCHEMBL9329894 0.80 SMN1; SMN2 (0.43) ANPEPERAP2SMN1; SMN2POLBHSD17B10
SCHEMBL28303412 0.79 SMN1; SMN2 (0.39) ANPEPERAP2SMN1; SMN2POLBHSD17B10
SCHEMBL3387998 0.78 SMN1; SMN2 (0.42) ANPEPERAP2SMN1; SMN2POLBHSD17B10
SCHEMBL2267331 0.78 ANPEP (0.44) ANPEPERAP2SMN1; SMN2POLBHSD17B10
SCHEMBL2267325 0.78 ANPEP (0.44) ANPEPERAP2SMN1; SMN2POLBHSD17B10

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
JP-11005786-A None JP disclosed
JP-H115786-A NOVEL AMINOHYDROXYPROPYLPIPERAZINE DERIVATIVE POLA CHEM IND INC 1999-01-12 JP disclosed