SCHEMBL4159004

SCHEMBL4159004

COc1ccc(C(F)(F)F)cc1C1=C(B(O)O)CCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.39
CYP2C9 P11712 2/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
HTR2A P28223 2/20 0.36
CETP P11597 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
RAB9A P51151 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
ACHE P22303 1/20 0.34
JAK2 O60674 1/20 0.34
JAK3 P52333 1/20 0.34
PTK2 Q05397 1/20 0.34
CASR P41180 2/20 0.34
MAPT P10636 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
NQO2 P16083 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL4159406 0.84 PTGER1 (0.36) PTGER1CYP2C9PTGDR2HTR2ACETP
SCHEMBL4155166 0.82 PTGER1 (0.38) PTGER1CYP2C9PTGDR2HTR2ACETP
SCHEMBL4151708 0.80 ERN1 (0.42) PTGER1CYP2C9RAB9AMAPTNPSR1
SCHEMBL5619867 0.79 PTGER1 (0.51) PTGER1CYP2C9
SCHEMBL4919236 0.77 PTGER1 (0.59) PTGER1CYP2C9PTGDR2HTR2C
SCHEMBL4924977 0.77 ALDH1A1 (0.44) RAB9AMAPTNPSR1
SCHEMBL29588618 0.72 ENPP2 (0.47) CYP2C9PTGDR2L3MBTL1RAB9AMAPT
SCHEMBL319585 0.72 ENPP2 (0.47) CYP2C9PTGDR2L3MBTL1RAB9AMAPT
SCHEMBL4146595 0.70 PTGER1 (0.52) PTGER1CYP2C9CYP3A4CYP2C19
SCHEMBL4158613 0.69 PTGER1 (0.51) PTGER1CYP2C9PTGDR2MAPTCYP3A4

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 5 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
EP-1670763-A1 CYCLOPENTENE COMPOUNDS GLAXO GROUP LIMITED (GB) 2006-06-21 EP disclosed
WO-2005037793-A1 CYCLOPENTENE COMPOUNDS GLAXO GROUP LIMITED (GB) 2005-04-28 WO 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 5/4885PTGDR2 231/4885

“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.