SCHEMBL2233435

SCHEMBL2233435

O=c1c2ncsc2nc(Oc2cc(F)c(F)c(F)c2)n1-c1ccc(F)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 3/20 0.35
CYP1A2 P05177 4/20 0.33
USP2 O75604 3/20 0.33
CYP3A4 P08684 3/20 0.33
GLA P06280 1/20 0.33
POLB P06746 1/20 0.32
DPP4 P27487 1/20 0.31
TP53 P04637 1/20 0.31
CYP2C19 P33261 2/20 0.31
ALDH1A1 P00352 2/20 0.31
CASP1 P29466 2/20 0.31
CASP7 P55210 2/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
HTT P42858 2/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
TSHR P16473 2/20 0.30
EP300 Q09472 1/20 0.30
CREBBP Q92793 1/20 0.30

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
SCHEMBL2234285 0.88 DPP4 (0.32) TRPV4CYP1A2USP2CYP3A4GLA
SCHEMBL2234873 0.86 DPP4 (0.33) TRPV4CYP1A2USP2CYP3A4GLA
SCHEMBL2233112 0.85 NPBWR1 (0.37) DPP4
SCHEMBL2236235 0.84 TRPV4 (0.32) TRPV4CYP1A2USP2CYP3A4GLA
SCHEMBL2236818 0.84 TRPV4 (0.38) TRPV4CYP1A2USP2CYP3A4GLA
SCHEMBL15826872 0.84 DPP4 (0.31) TRPV4CYP1A2USP2CYP3A4GLA
SCHEMBL2233206 0.84 SLC22A12 (0.34) TRPV4CYP1A2USP2CYP3A4GLA
SCHEMBL2237030 0.82 MAT2A (0.36) TSHRMEN1KMT2A
SCHEMBL2234818 0.81 P2RY1 (0.38) CYP1A2POLBCYP2C19ALDH1A1MAPK1
SCHEMBL15826878 0.81 CYP1A2 (0.35) TRPV4CYP1A2USP2CYP3A4DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2061794-B1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORP (US) 2012-12-05 EP claimed
US-20120208829-A1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORPORATION (US) 2012-08-16 US claimed
US-20090069347-A1 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2009-03-12 US claimed
US-8759361-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2014-06-24 US disclosed
US-8759361-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2014-06-24 US disclosed
US-8759361-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2014-06-24 US disclosed
EP-2061794-B1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORP (US) 2012-12-05 EP disclosed
US-20120208829-A1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORPORATION (US) 2012-08-16 US disclosed
US-20120208829-A1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORPORATION (US) 2012-08-16 US disclosed
US-20120208829-A1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORPORATION (US) 2012-08-16 US disclosed
US-8003656-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2011-08-23 US disclosed
US-8003656-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2011-08-23 US disclosed
US-8003656-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2011-08-23 US disclosed
US-20090069347-A1 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2009-03-12 US disclosed
US-20090069347-A1 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2009-03-12 US disclosed
US-20090069347-A1 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2009-03-12 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 (2 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-20120208829-A1 2-PHENOXY PYRIMIDINONE ANALOGUES GPR174, GPR17, PTGFR TRPV4 1155/4885CYP1A2 757/4885USP2 4390/4885
US-20090069347-A1 2-phenoxy pyrimidinone analogues GPR174, GPR17, PTGFR TRPV4 1155/4885CYP1A2 757/4885USP2 4390/4885

“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.