SCHEMBL4732787

SCHEMBL4732787

CCc1ccc(C(=O)N2CCC(Cc3ccccc3)CC2)cc1NC(=O)c1ccc(Cl)nc1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
SMN1; SMN2 Q16637 4/20 0.55
LMNA P02545 1/20 0.55
PRSS12 P56730 7/20 0.52
FASN P49327 1/20 0.49
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
NPBWR1 P48145 1/20 0.47
MCHR1 Q99705 1/20 0.47
PKM P14618 1/20 0.47
MGLL Q99685 1/20 0.47

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
SCHEMBL14209232 0.92 MEN1 (0.54) MEN1KMT2ASMN1; SMN2LMNAPRSS12
SCHEMBL4737601 0.90 FASN (0.59) MEN1KMT2ASMN1; SMN2LMNAPRSS12
SCHEMBL4784366 0.90 FASN (0.49) MEN1KMT2ASMN1; SMN2LMNAPRSS12
SCHEMBL4731259 0.78 SMN1; SMN2 (0.54) MEN1KMT2ASMN1; SMN2LMNAPRSS12
SCHEMBL16799516 0.77 FASN (0.56) FASN
SCHEMBL4737156 0.76 FASN (0.72) MEN1KMT2APRSS12FASN
SCHEMBL4732268 0.76 FASN (0.59) MEN1KMT2ASMN1; SMN2FASNALDH1A1
SCHEMBL4731357 0.76 CA12 (0.61) MEN1KMT2ASMN1; SMN2ALDH1A1HTT
SCHEMBL4731899 0.73 SMN1; SMN2 (0.47) MEN1KMT2ASMN1; SMN2LMNAPRSS12
SCHEMBL5909349 0.72 MEN1 (0.65) MEN1KMT2ASMN1; SMN2ALDH1A1HTT

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-2008059214-A1 BISAMLDE DERIVATIVES AND USE THEREOF AS FATTY ACID SYNTHASE INHIBITORS ASTRAZENECA AB (SE) 2008-05-22 WO disclosed