SCHEMBL7876376

SCHEMBL7876376

O=C(OC[C@H]1O[C@@H](Br)[C@@H](F)[C@@H]1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
MEN1 O00255 1/20 0.49
USP2 O75604 1/20 0.49
KMT2A Q03164 1/20 0.49
PTPN1 P18031 4/20 0.44
ALDH1A1 P00352 2/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
LGALS9 O00182 1/20 0.43
LGALS1 P09382 1/20 0.43
LGALS3 P17931 1/20 0.43
LGALS7; LGALS7B P47929 1/20 0.43
PTPN2 P17706 1/20 0.42
PTPN11 Q06124 1/20 0.42
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GAPDH P04406 2/20 0.40
HRAS P01112 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
SCHEMBL14356291 1.00 POLB (0.49) POLBMEN1USP2KMT2APTPN1
SCHEMBL973605 1.00 POLB (0.49) POLBMEN1USP2KMT2APTPN1
SCHEMBL4736023 1.00 POLB (0.49) POLBMEN1USP2KMT2APTPN1
SCHEMBL20141686 1.00 POLB (0.49) POLBMEN1USP2KMT2APTPN1
SCHEMBL13396032 1.00 POLB (0.49) POLBMEN1USP2KMT2APTPN1
SCHEMBL8393091 1.00 POLB (0.49) POLBMEN1USP2KMT2APTPN1
SCHEMBL4570559 1.00 POLB (0.49) POLBMEN1USP2KMT2APTPN1
SCHEMBL10062435 1.00 POLB (0.49) POLBMEN1USP2KMT2APTPN1
SCHEMBL15468165 1.00 POLB (0.49) POLBMEN1USP2KMT2APTPN1
SCHEMBL8636329 1.00 POLB (0.49) POLBMEN1USP2KMT2APTPN1

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
US-8871785-B2 Antiviral phosphonate analogs GILEAD SCIENCES, INC. (US) 2014-10-28 US disclosed
US-6331287-B1 NONCATABOLIZING IMAGING AGENT FOR POSITRON EMISSION TOMOGRAPHY; UNIVERSITY ADVANCED BIO-IMAGING ASSOCIATES 2001-12-18 US disclosed