SCHEMBL15528004

SCHEMBL15528004

O=c1c(-c2cccc(F)c2)c(CCOCc2ccccc2)oc2ccc(F)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 7/20 0.44
GABRD O14764 7/20 0.44
GABRA1 P14867 7/20 0.44
GABRB1 P18505 7/20 0.44
GABRG2 P18507 7/20 0.44
GABRB3 P28472 7/20 0.44
GABRA5 P31644 7/20 0.44
GABRA3 P34903 7/20 0.44
GABRA2 P47869 7/20 0.44
GABRB2 P47870 7/20 0.44
GABRA4 P48169 7/20 0.44
GABRE P78334 7/20 0.44
GABRA6 Q16445 7/20 0.44
GABRG1 Q8N1C3 7/20 0.44
GABRG3 Q99928 7/20 0.44
GABRQ Q9UN88 7/20 0.44
TNKS O95271 1/20 0.42
ASAH1 Q13510 1/20 0.41
ACP1 P24666 1/20 0.40
PTPN1 P18031 1/20 0.39

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
SCHEMBL15528175 0.95 TNKS (0.44) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL15528081 0.94 POLB (0.44) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL15528093 0.88 POLB (0.42) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL15528064 0.82 CA1 (0.49) ASAH1PTPN1ABCG2ABCB1CA1
SCHEMBL15528285 0.79 GABRP (0.51) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8932 0.79 GABRP (0.51) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL15528157 0.77 PIK3CD (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL16457581 0.77 PIK3CD (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9273 0.77 GABRP (0.53) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8856 0.77 GABRA1 (0.53) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2914343-A1 COMBINATION OF ANTI-CD20 ANTIBODY AND PI3 KINASE SELECTIVE INHIBITOR TG Therapeutics Inc. (US) 2015-09-09 EP disclosed
EP-2870157-A1 SELECTIVE PI3K DELTA INHIBITORS Rhizen Pharmaceuticals S.A. (CH) 2015-05-13 EP disclosed
EP-2844647-A1 PROCESS FOR PREPARATION OF OPTICALLY PURE AND OPTIONALLY SUBSTITUTED 2- (1 -HYDROXY- ALKYL) - CHROMEN - 4 - ONE DERIVATIVES AND THEIR USE IN PREPARING PHARMACEUTICALS Rhizen Pharmaceuticals S.A. (CH) 2015-03-11 EP disclosed
WO-2014071125-A1 COMBINATION OF ANTI-CD20 ANTIBODY AND PI3 KINASE SELECTIVE INHIBITOR TG THERAPEUTICS, INC. (US) 2014-05-08 WO disclosed
WO-2014006572-A1 SELECTIVE PI3K DELTA INHIBITORS RHIZEN PHARMACEUTICALS SA (CH) 2014-01-09 WO disclosed
WO-2013164801-A1 PROCESS FOR PREPARATION OF OPTICALLY PURE AND OPTIONALLY SUBSTITUTED 2- (1 -HYDROXY- ALKYL) - CHROMEN - 4 - ONE DERIVATIVES AND THEIR USE IN PREPARING PHARMACEUTICALS RHIZEN PHARMACEUTICALS SA (CH) 2013-11-07 WO disclosed
US-20090143565-A1 Methods for the Synthesis of Two or More Dicarba Bridges in Organic Compounds SYNGENE LIMITED (AU) 2009-06-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090143565-A1 Methods for the Synthesis of Two or More Dicarba Bridges in Organic Compounds OTC, NBAS, IDH2 GABRP 2716/4885GABRD 2470/4885GABRA1 2312/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.