SCHEMBL6897061

SCHEMBL6897061

COC(=O)[C@H](CCSC)NC(=O)c1ccc(Sc2sccc2Nc2nccs2)cc1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.49
FNTB P49356 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
KMT2A Q03164 1/20 0.45
APOBEC3G Q9HC16 1/20 0.41

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
SCHEMBL6897056 1.00 FNTA (0.49) FNTAFNTBTDP1KMT2AAPOBEC3G
SCHEMBL6897194 0.85 FNTA (0.51) FNTAFNTBTDP1KMT2A
SCHEMBL6897196 0.85 FNTA (0.51) FNTAFNTBTDP1KMT2A
SCHEMBL6896846 0.84 FNTA (0.51) FNTAFNTBTDP1KMT2A
SCHEMBL6896848 0.84 FNTA (0.51) FNTAFNTBTDP1KMT2A
SCHEMBL7606256 0.82 FNTA (0.49) FNTAFNTBTDP1KMT2A
SCHEMBL6624205 0.80 FNTA (0.56) FNTAFNTBTDP1KMT2A
SCHEMBL6628129 0.80 FNTA (0.56) FNTAFNTBTDP1KMT2A
SCHEMBL6774858 0.78 FNTA (0.54) FNTAFNTBTDP1KMT2A
SCHEMBL6891553 0.77 FNTA (0.53) FNTAFNTBTDP1KMT2A

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-6693123-B2 (4-(3-PYRIDYLAMINOMETHYLENE)-2-PHENYLBENZOYL)-N -METHYLMETHIONINE, METHYL ESTER FOR EXAMPLE; RESTENOSIS, HYPERPLASIA UNIVERSITY OF PITTSBURGH 2004-02-17 US disclosed