SCHEMBL11694258

SCHEMBL11694258

CCCOP(=O)(OCCC)N(C)SCl

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.37
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TSHR P16473 1/20 0.32
TP53 P04637 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL11046301 0.79 MEN1 (0.33) CYP3A4MEN1KMT2A
SCHEMBL11693180 0.76 MEN1 (0.32) CYP3A4MEN1KMT2A
SCHEMBL10987709 0.72 CYP3A4 (0.40) CYP3A4MEN1KMT2ATSHRTP53
SCHEMBL11058719 0.70
SCHEMBL11134997 0.67 TP53 (0.39) CYP3A4MEN1KMT2ATSHRTP53
SCHEMBL11159129 0.65 MEN1 (0.35) CYP3A4MEN1KMT2ATSHR
SCHEMBL10403951 0.64 CYP3A4 (0.42) CYP3A4MEN1KMT2ATSHRTP53
SCHEMBL7080042 0.64 CYP3A4 (0.42) CYP3A4MEN1KMT2ATSHRTP53
SCHEMBL177846 0.64 TP53 (0.46) CYP3A4MEN1KMT2ATSHRTP53
SCHEMBL3129990 0.64

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-4024277-A INSECTICIDE AND PESTICIDE FMC CORPORATION (US) 1977-05-17 US disclosed