SCHEMBL27474183

SCHEMBL27474183

NC(=O)Oc1ccc(N2CCC(N)CC2)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ACACB O00763 6/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
FFAR4 Q5NUL3 1/20 0.38
CHRNA3 P32297 1/20 0.38
MAPT P10636 2/20 0.37
CHRM4 P08173 1/20 0.37

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
SCHEMBL18803820 0.82 HPGD (0.53) HPGDSMN1; SMN2KMT2A
SCHEMBL21397329 0.80 ACACB (0.47) GAAACACBKMT2A
SCHEMBL30815847 0.80 ACACB (0.47) GAAACACBKMT2A
SCHEMBL383774 0.75 HPGD (0.60) GAAHPGDSMN1; SMN2KMT2AMEN1
SCHEMBL4539952 0.75 ALDH1A1 (0.45) GAAHPGDSMN1; SMN2ACACBKMT2A
SCHEMBL12074106 0.73 ALDH1A1 (0.59) GAAHPGDSMN1; SMN2KMT2AMEN1
SCHEMBL23536333 0.72 SSTR2 (0.45) GAAKMT2AMEN1MAPT
SCHEMBL13419247 0.72 SSTR2 (0.43) GAAHPGDSMN1; SMN2ACACBMAPT
SCHEMBL29931979 0.72 SSTR2 (0.45) GAAKMT2AMEN1MAPT
SCHEMBL5265818 0.70 MEN1 (0.57) KMT2AMEN1

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
CN-1140511-C As integrin alphavβ3Aminopiperidine derivatives as antagonists �����Ƹ���ʽ���� 2004-03-03 CN disclosed