SCHEMBL4093589

SCHEMBL4093589

O=C(O)c1c(-c2ccc(OC(F)(F)F)cc2)c2sc(-c3ccc(OC(F)(F)F)cc3)cc2n1Cc1cccc(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 1.00
SERPINE1 P05121 3/20 0.51
TRPV1 Q8NER1 1/20 0.43
FEN1 P39748 2/20 0.42
CSNK1D P48730 1/20 0.42
CCR2 P41597 1/20 0.40
PPARG P37231 8/20 0.40
PPARA Q07869 7/20 0.40
CYP2C9 P11712 1/20 0.40
EGFR P00533 1/20 0.40
CHRM4 P08173 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRA2A P08913 1/20 0.40
ALOX5 P09917 1/20 0.40
ADRB3 P13945 1/20 0.40
DRD2 P14416 1/20 0.40
ADRA2B P18089 1/20 0.40
CHRM3 P20309 1/20 0.40
TACR2 P21452 1/20 0.40
DRD1 P21728 1/20 0.40

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
SCHEMBL4092264 0.89 PTGES (0.81) PTGESSERPINE1TRPV1CSNK1DPPARG
SCHEMBL4092414 0.84 PTGES (0.72) PTGESSERPINE1CCR2CYP2C9ERCC5
SCHEMBL5812761 0.79 PTGES (0.65) PTGESSERPINE1PPARGPPARA
SCHEMBL4086539 0.76 PTGES (0.62) PTGESSERPINE1
SCHEMBL6092421 0.73 PTGES (0.57) PTGESSERPINE1TRPV1PPARGPPARA
SCHEMBL15511024 0.72 PTGES (0.56) PTGESSERPINE1PPARGCHRM4PTGER4
SCHEMBL15497058 0.71 PTGES (0.55) PTGESCCR2ERCC5
SCHEMBL6091132 0.71 PTGES (0.55) PTGESSERPINE1CCR2ADRB1ADRB3
SCHEMBL6093213 0.71 PTGES (0.55) PTGESSERPINE1TRPV1PPARGPPARA
SCHEMBL6093568 0.70 PTGES (0.54) PTGESSERPINE1CCR2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069384-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2009-03-12 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-20090069384-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION NPY5R, TH, PTGES PTGES 3/4885SERPINE1 1731/4885TRPV1 866/4885

“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.