SCHEMBL14209232

SCHEMBL14209232

C=C(c1ccc(CC)c(NC(=O)c2ccc(Cl)nc2)c1)N1CCC(Cc2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
LMNA P02545 2/20 0.54
FAAH O00519 1/20 0.45
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PRSS12 P56730 2/20 0.44
CCR3 P51677 1/20 0.43
PKM P14618 1/20 0.42

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
SCHEMBL4732787 0.92 MEN1 (0.56) MEN1KMT2ASMN1; SMN2LMNAPRSS12
SCHEMBL4784366 0.83 FASN (0.49) MEN1KMT2ASMN1; SMN2LMNAPRSS12
SCHEMBL4737601 0.82 FASN (0.59) MEN1KMT2ASMN1; SMN2LMNANPSR1
SCHEMBL14210096 0.78 FASN (0.55) SMN1; SMN2LMNAMAPTNPSR1
SCHEMBL14209226 0.75 FASN (0.59) MEN1KMT2ASMN1; SMN2
SCHEMBL14209842 0.75 KDM4E (0.57) POLBMAPTNPSR1
SCHEMBL14210046 0.71 FASN (0.60) LMNA
SCHEMBL4731259 0.70 SMN1; SMN2 (0.54) MEN1KMT2ASMN1; SMN2LMNANPSR1
SCHEMBL14209877 0.69 FASN (0.58)
SCHEMBL16799516 0.69 FASN (0.56)

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