SCHEMBL4154455

SCHEMBL4154455

CCOC(=O)c1cc(C2=C(c3cc(Cl)c(Cl)cc3O)CCC2)cnc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.42
PTGER1 P34995 1/20 0.42
KDM4E B2RXH2 5/20 0.40
SLC6A3 Q01959 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 2/20 0.37
DYRK1A Q13627 1/20 0.37
CYP1A2 P05177 2/20 0.37
P2RY12 Q9H244 3/20 0.37
IDO1 P14902 1/20 0.36
MEN1 O00255 1/20 0.36
MAPK10 P53779 1/20 0.36
KMT2A Q03164 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ATF1 P18846 1/20 0.35

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
SCHEMBL4159789 0.89 CYP2C9 (0.41) CYP2C9PTGER1KDM4ESLC6A3NPSR1
SCHEMBL13696751 0.88 PTGER1 (0.43) CYP2C9PTGER1KDM4ENPSR1MEN1
SCHEMBL4146588 0.87 MAPT (0.41) CYP2C9PTGER1KDM4ENPSR1ALDH1A1
SCHEMBL4158824 0.85 PTGER1 (0.44) CYP2C9PTGER1SLC6A3
SCHEMBL4157965 0.82 PTGER1 (0.45) CYP2C9PTGER1KDM4ESLC6A3ALDH1A1
SCHEMBL4159511 0.79 PTGER1 (0.54) CYP2C9PTGER1KDM4EALDH1A1MEN1
SCHEMBL4154224 0.79 PTGER1 (0.49) CYP2C9PTGER1CYP2C19MRGPRX4
SCHEMBL4146879 0.78 PTGER1 (0.56) CYP2C9PTGER1
SCHEMBL4168540 0.78 PTGER1 (0.49) CYP2C9PTGER1CYP2C19MRGPRX4
SCHEMBL4147293 0.77 PTGER1 (0.42) CYP2C9PTGER1GAATSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 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-20090227591-A1 Cyclopentene compounds C1R, CYP1B1, ADORA2B CYP2C9 5/4885PTGER1 246/4885KDM4E 2449/4885

“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.