SCHEMBL1123587

SCHEMBL1123587

NS(=O)(=O)c1ccc(-n2cc(C(F)(F)F)cc2-c2cc(Cl)ccc2Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.53
PTGS1 P23219 11/20 0.53
PDPK1 O15530 4/20 0.46
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
CYP2C9 P11712 1/20 0.43
CHRNA7 P36544 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42

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
SCHEMBL1123613 0.81 PTGS2 (0.60) PTGS2PTGS1PDPK1CYP2C9CHRNA7
SCHEMBL5674345 0.79 PTGS2 (0.83) PTGS2PTGS1PDPK1CYP2C9
SCHEMBL1123595 0.77 KIF11 (0.51) PTGS2PTGS1PDPK1CYP2C9CA12
SCHEMBL1123619 0.76 PTGES (0.65) PTGS2PTGS1PDPK1LMNACYP2C9
SCHEMBL7216291 0.74 PTGS2 (0.62) PTGS2PTGS1PDPK1CYP2C9CHRNA7
SCHEMBL1270876 0.74 PTGS2 (0.62) PTGS2PTGS1PDPK1CYP2C9CHRNA7
SCHEMBL1123783 0.73 PTGS2 (0.61) PTGS2PTGS1PDPK1LMNACYP2C9
SCHEMBL5594452 0.73 PTGS2 (0.71) PTGS2PTGS1
SCHEMBL3246957 0.69 PTGS2 (1.00) PTGS2PTGS1PDPK1CYP2C9
SCHEMBL8121672 0.69 PTGS2 (0.70) PTGS2PTGS1PDPK1CYP2C9CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120196915-A1 Antitumor 1,2-Diphenylpyrrole Compounds and their Preparation Process ARGON PHARMA, S.L. (ES) 2012-08-02 US claimed
EP-2459532-A1 ANTITUMOR 1,2-DIPHENYLPYRROLE COMPOUNDS AND THEIR PREPARATION PROCESS Argon Pharma S.L. (ES) 2012-06-06 EP claimed
EP-2284154-A1 Antitumor 1,2-diphenylpyrrole compounds and their preparation process Argon Pharma S.L. (ES) 2011-02-16 EP claimed
WO-2011012660-A1 ANTITUMOR 1,2-DIPHENYLPYRROLE COMPOUNDS AND THEIR PREPARATION PROCESS ARGON PHARMA, S. L. (ES) 2011-02-03 WO claimed
US-20120196915-A1 Antitumor 1,2-Diphenylpyrrole Compounds and their Preparation Process ARGON PHARMA, S.L. (ES) 2012-08-02 US disclosed
EP-2459532-A1 ANTITUMOR 1,2-DIPHENYLPYRROLE COMPOUNDS AND THEIR PREPARATION PROCESS Argon Pharma S.L. (ES) 2012-06-06 EP disclosed
EP-2284154-A1 Antitumor 1,2-diphenylpyrrole compounds and their preparation process Argon Pharma S.L. (ES) 2011-02-16 EP disclosed
WO-2011012660-A1 ANTITUMOR 1,2-DIPHENYLPYRROLE COMPOUNDS AND THEIR PREPARATION PROCESS ARGON PHARMA, S. L. (ES) 2011-02-03 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-20120196915-A1 Antitumor 1,2-Diphenylpyrrole Compounds and their Preparation Process H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TPD52L2, CYC1 PTGS2 1289/4885PTGS1 1559/4885PDPK1 841/4885

“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.