SCHEMBL11283176

SCHEMBL11283176

CCC(C)C(=O)SCC(=O)N(CC(=O)OC)c1c(C)ccc(Cl)c1C

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.37
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.31
MEN1 O00255 1/20 0.30
PKM P14618 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL11274271 0.91 RAB9A (0.33) RAB9AMAPTALDH1A1MEN1KMT2A
SCHEMBL11279890 0.91 RAB9A (0.38) RAB9AKDM4EMAPTALDH1A1HTT
SCHEMBL11284341 0.90 RAB9A (0.39) RAB9AKDM4EMAPTALDH1A1HTT
SCHEMBL11292054 0.89 SMN1; SMN2 (0.32)
SCHEMBL11277444 0.88 RAB9A (0.31) RAB9A
SCHEMBL11271232 0.86 RAB9A (0.40) RAB9AKDM4EMAPTALDH1A1HTT
SCHEMBL11272283 0.86 ALDH1A1 (0.34) RAB9AALDH1A1HTTMEN1KMT2A
SCHEMBL11277985 0.85 RAB9A (0.34) RAB9AKDM4EMAPTALDH1A1
SCHEMBL11277898 0.85 RAB9A (0.41) RAB9AKDM4EMAPTALDH1A1HTT
SCHEMBL11276489 0.84 RAB9A (0.38) RAB9AKDM4EMAPTALDH1A1MEN1

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
US-4313957-A Pesticidal sulfur containing amides derived from aniline and the method of preparation thereof RHONE-POULENC AGROCHIMIE (FR) 1982-02-02 US disclosed