SCHEMBL4165872

SCHEMBL4165872

Cc1ncc(C2=C(c3cc(Cl)ccc3O)CCC2)cc1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 9/20 0.64
CYP2C9 P11712 6/20 0.64
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
ALDH1A1 P00352 2/20 0.38
TP53 P04637 1/20 0.38
VEGFA P15692 1/20 0.38
FLT1 P17948 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
MAPT P10636 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C19 P33261 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL4149095 0.88 PTGER1 (0.54) PTGER1CYP2C9ALDH1A1VEGFAFLT1
SCHEMBL4159511 0.86 PTGER1 (0.54) PTGER1CYP2C9CA1CA2ALDH1A1
SCHEMBL4156020 0.86 PTGER1 (0.52) PTGER1CYP2C9CA1CA2ALDH1A1
SCHEMBL4168890 0.81 PTGER1 (0.90) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4159750 0.81 PTGER1 (0.85) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4162596 0.79 PTGER1 (0.84) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4154632 0.79 PTGER1 (1.00) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4159477 0.78 PTGER1 (0.79) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4166337 0.78 PTGER1 (0.77) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4163566 0.78 PTGER1 (0.77) PTGER1CYP2C9CYP3A4CYP2C19

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 5/4885CA1 2841/4885

“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.