SCHEMBL4154000

SCHEMBL4154000

CCOC(=O)c1cc(C2=C(c3cc(Cl)cnc3OCc3ccccc3F)CCC2)ccc1F

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 9/20 0.42
CYP2C9 P11712 6/20 0.40
TDP1 Q9NUW8 1/20 0.38
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 1/20 0.37
TP53 P04637 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
NPC1 O15118 1/20 0.36
GLA P06280 1/20 0.36
TSHR P16473 1/20 0.36
MAPT P10636 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
CYP1A2 P05177 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
SMN1; SMN2 Q16637 2/20 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
SCHEMBL4155862 0.93 PTGER1 (0.41) PTGER1CYP2C9CYP2C19CYP3A4L3MBTL1
SCHEMBL4154379 0.92 PTGER1 (0.47) PTGER1CYP2C9CYP2C19CYP3A4TP53
SCHEMBL4156272 0.92 PTGER1 (0.46) PTGER1CYP2C9CYP2C19CYP3A4NPC1
SCHEMBL4150598 0.91 PTGER1 (0.46) PTGER1CYP2C9CYP2C19CYP3A4NPC1
SCHEMBL4162650 0.91 PTGER1 (0.41) PTGER1CYP2C9TP53L3MBTL1NPC1
SCHEMBL4149186 0.91 PTGER1 (0.41) PTGER1CYP2C9CYP2C19CYP3A4NPC1
SCHEMBL4163577 0.91 PTGER1 (0.48) PTGER1CYP2C9MAPT
SCHEMBL4168715 0.91 PTGER1 (0.41) PTGER1CYP2C9CYP2C19CYP3A4NPC1
SCHEMBL4149701 0.89 MRGPRX4 (0.39) PTGER1CYP2C9L3MBTL1NPC1GLA
SCHEMBL4162800 0.89 PTGER1 (0.49) PTGER1CYP2C9CYP2C19CYP3A4

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 5/4885TDP1 4069/4885

“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.