SCHEMBL10013939

SCHEMBL10013939

CC/N=c1\ccc2c(-c3ccccc3C(=O)O)c3ccc(CNC)cc3oc-2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 4/20 0.42
▸ ATM Q13315 2/20 0.42
▸ CFTR P13569 1/20 0.42
▸ PAX8 Q06710 1/20 0.42
▸ GOPC Q9HD26 1/20 0.42
▸ ABCB1 P08183 1/20 0.42
▸ FTO Q9C0B1 2/20 0.39
▸ ESR1 P03372 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ BRCA1 P38398 1/20 0.38
▸ HTT P42858 1/20 0.38

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
SCHEMBL16021690 0.85 ESR1 (0.42) USP2ATMCFTRPAX8GOPC
SCHEMBL6056224 0.85 ABCB1 (0.43) USP2ATMCFTRPAX8GOPC
SCHEMBL12056738 0.85 ABCB1 (0.43) USP2ATMCFTRPAX8GOPC
SCHEMBL6056220 0.85 ABCB1 (0.43) USP2ATMCFTRPAX8GOPC
SCHEMBL14071809 0.85 USP2 (0.59) USP2ATMCFTRPAX8GOPC
SCHEMBL20862074 0.85 ABCB1 (0.56) USP2ATMCFTRPAX8GOPC
Hydrochloric Acid SCHEMBL28449515 0.84 USP2 (0.43) USP2ATMCFTRPAX8GOPC
SCHEMBL14064053 0.83 MEN1 (0.48) USP2ATMCFTRPAX8GOPC
SCHEMBL15100483 0.82 TGM2 (0.42) USP2ATMCFTRPAX8GOPC
SCHEMBL17517217 0.82 TGM2 (0.42) USP2ATMCFTRPAX8GOPC

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-8148141-B2 Solid support comprising fixed amino acid sequences with cysteine terminals for use as recognition tool for detection of preferential polypeptides in solution; high throughput assay HIPEP LABORATORIES (JP) 2012-04-03 — — US disclosed
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