SCHEMBL11273473

SCHEMBL11273473

COC(=O)CN(C(=O)CSC(=O)C(C)C)c1c(C)ccc(Br)c1C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.33
RAB9A P51151 1/20 0.32
HPGD P15428 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL11275039 0.91 MLYCD (0.36) MLYCDRAB9AHPGDALDH1A1
SCHEMBL11277444 0.90 RAB9A (0.31) RAB9A
SCHEMBL11277482 0.89 RAB9A (0.31) RAB9A
SCHEMBL11290056 0.89 MLYCD (0.30) MLYCD
SCHEMBL11266992 0.87 RAB9A (0.34) RAB9AHPGDALDH1A1
SCHEMBL11270788 0.87 CYP1A2 (0.33) MLYCDRAB9AHPGD
SCHEMBL11284341 0.87 RAB9A (0.39) MLYCDRAB9AALDH1A1
SCHEMBL11281203 0.85 RAB9A (0.35) RAB9AHPGDALDH1A1
SCHEMBL11275836 0.85 NPSR1 (0.38) MLYCDRAB9AHPGDTDP1ALDH1A1
SCHEMBL11279726 0.84 RAB9A (0.32) RAB9AHPGDALDH1A1

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