SCHEMBL11670623

SCHEMBL11670623

CN(CCC=O)C(=O)Nc1nnc(C2CCCCC2)s1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.54
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
NPC1 O15118 6/20 0.52
RAB9A P51151 6/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
HPGD P15428 1/20 0.52
HSD17B10 Q99714 1/20 0.52
TSHR P16473 1/20 0.50
GFER P55789 1/20 0.47
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46

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
SCHEMBL11669924 1.00 ALDH1A1 (0.54) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL11669564 0.94 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL11551498 0.89 ALDH1A1 (0.57) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL11682140 0.89 ALDH1A1 (0.57) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL11549721 0.88 ALDH1A1 (0.56) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL11669894 0.84 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL11669802 0.83 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL11683084 0.83 ALDH1A1 (0.54) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL11670080 0.82 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL11863051 0.79 ALDH1A1 (0.54) ALDH1A1MEN1KMT2ANPC1RAB9A

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-4004912-A 1-Thiadiazolyl-6-acyloxytetrahydropyrimidinone herbicides VELSICOL CHEMICAL CORPORATION (US) 1977-01-25 US disclosed