SCHEMBL14619724

SCHEMBL14619724

O=C(CSCCC(=O)ON1C(=O)CCC1=O)NC1CCC(NC(=O)c2ccc(-c3c4ccc(=O)cc-4oc4cc(O)ccc34)c(C(=O)O)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ FOLH1 Q04609 3/20 0.45
▸ CA9 Q16790 5/20 0.45
▸ ALB P02768 2/20 0.45
▸ ESR1 P03372 1/20 0.43
▸ SLC5A2 P31639 2/20 0.42
▸ FKBP1A P62942 2/20 0.41
▸ HAVCR2 Q8TDQ0 1/20 0.40
▸ CA1 P00915 3/20 0.40
▸ CA2 P00918 3/20 0.40
▸ CA12 O43570 2/20 0.40
▸ HTR3A P46098 1/20 0.40

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
SCHEMBL1688099 0.90 FOLH1 (0.51) USP2L3MBTL1FOLH1CA9ALB
SCHEMBL9906325 0.89 FOLH1 (0.54) USP2L3MBTL1FOLH1CA9ALB
SCHEMBL9906321 0.89 FOLH1 (0.55) USP2L3MBTL1FOLH1CA9ALB
SCHEMBL9906327 0.88 FOLH1 (0.52) USP2L3MBTL1FOLH1CA9ALB
SCHEMBL9906326 0.87 FOLH1 (0.56) USP2L3MBTL1FOLH1CA9ALB
SCHEMBL13678665 0.87 ESR1 (0.52) USP2L3MBTL1FOLH1CA9ALB
SCHEMBL9906226 0.86 ALB (0.49) USP2L3MBTL1FOLH1CA9ALB
SCHEMBL1688096 0.85 CA9 (0.52) USP2L3MBTL1CA9FKBP1ACA1
SCHEMBL29837449 0.85 CA9 (0.52) USP2L3MBTL1CA9FKBP1ACA1
SCHEMBL9906258 0.85 FOLH1 (0.52) USP2L3MBTL1FOLH1CA9ALB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1673399-B1 DETECTING AND PROFILING MOLECULAR COMPLEXES MONOGRAM BIOSCIENCES INC (US) 2017-04-05 — — EP disclosed
US-7160735-B2 Tagged microparticle compositions and methods MONOGRAM BIOSCIENCES, INC. (US) 2007-01-09 — — US disclosed
Send feedback