SCHEMBL4154404

SCHEMBL4154404

CCOC(=O)c1cc(C2=C(c3cc(Cl)ccc3O)CCC2)cnn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 3/20 0.54
CYP2C9 P11712 2/20 0.40
KDM4E B2RXH2 3/20 0.39
KMT2A Q03164 3/20 0.39
GABRA2 P47869 8/20 0.37
GABRB2 P47870 8/20 0.37
MAPT P10636 3/20 0.37
TSHR P16473 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
MAPK1 P28482 1/20 0.36
RECQL P46063 1/20 0.36
MEN1 O00255 2/20 0.35
RXFP1 Q9HBX9 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
SCHEMBL4159867 0.88 PTGER1 (0.41) PTGER1GABRA2GABRB2MAPTSMN1; SMN2
SCHEMBL4149780 0.82 PTGER1 (0.82) PTGER1CYP2C9
SCHEMBL5620218 0.82 CYP2C9 (0.43) PTGER1CYP2C9KDM4EKMT2AMAPT
SCHEMBL4159511 0.82 PTGER1 (0.54) PTGER1CYP2C9KDM4EKMT2AMAPT
SCHEMBL5620105 0.82 PTGER1 (0.49) PTGER1CYP2C9KDM4EKMT2AMAPT
SCHEMBL4150313 0.81 PTGER1 (0.68) PTGER1CYP2C9
SCHEMBL4922664 0.80 CYP2C9 (0.43) PTGER1CYP2C9KDM4EKMT2AMAPT
SCHEMBL13696868 0.80 PTGER1 (0.64) PTGER1CYP2C9
SCHEMBL5620244 0.80 PTGER1 (0.49) PTGER1CYP2C9KDM4EKMT2AGABRA2
SCHEMBL13696869 0.79 PTGER1 (0.64) PTGER1CYP2C9

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 PTGER1 246/4885CYP2C9 5/4885KDM4E 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.