SCHEMBL4157965

SCHEMBL4157965

COC(=O)c1cc(C2=C(c3cc(Cl)ccc3O)CCC2)cnc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.45
CYP2C9 P11712 1/20 0.45
SLC6A3 Q01959 7/20 0.39
TMPRSS4 Q9NRS4 6/20 0.38
GAA P10253 1/20 0.38
P2RX1 P51575 1/20 0.36
P2RX4 Q99571 1/20 0.36
P2RX7 Q99572 1/20 0.36
SLC6A2 P23975 3/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 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
SCHEMBL4147293 0.89 PTGER1 (0.42) PTGER1CYP2C9TMPRSS4GAASLC6A2
SCHEMBL4149095 0.86 PTGER1 (0.54) PTGER1CYP2C9SLC6A3SLC6A2KDM4E
SCHEMBL13697406 0.85 PTGER1 (0.50) PTGER1CYP2C9KDM4ETP53MAPT
SCHEMBL4159290 0.83 PTGER1 (0.61) PTGER1CYP2C9
SCHEMBL4156313 0.82 PTGER1 (0.54) PTGER1CYP2C9
SCHEMBL4164013 0.82 PTGER1 (0.70) PTGER1CYP2C9
SCHEMBL4164130 0.82 PTGER1 (0.53) PTGER1CYP2C9
SCHEMBL4153423 0.82 PTGER1 (0.55) PTGER1CYP2C9
SCHEMBL4444586 0.82 PTGER1 (0.53) PTGER1CYP2C9
SCHEMBL13696809 0.82 PTGER1 (0.53) 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 5/4885SLC6A3 4650/4885

“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.