SCHEMBL1123595

SCHEMBL1123595

NS(=O)(=O)c1ccc(-n2cc(C(F)(F)F)cc2-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.51
PTGS2 P35354 17/20 0.51
CYP2C9 P11712 1/20 0.51
PDPK1 O15530 1/20 0.50
PTGS1 P23219 12/20 0.49
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47

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 0.88 PTGS2 (0.60) KIF11PTGS2CYP2C9PDPK1PTGS1
SCHEMBL1123783 0.88 PTGS2 (0.61) KIF11PTGS2CYP2C9PDPK1PTGS1
SCHEMBL7216291 0.86 PTGS2 (0.62) KIF11PTGS2CYP2C9PDPK1PTGS1
SCHEMBL1270876 0.86 PTGS2 (0.62) KIF11PTGS2CYP2C9PDPK1PTGS1
SCHEMBL1123587 0.77 PTGS2 (0.53) PTGS2CYP2C9PDPK1PTGS1CA12
SCHEMBL1123619 0.77 PTGES (0.65) PTGS2CYP2C9PDPK1PTGS1CA12
SCHEMBL1123796 0.74 PTGS2 (0.46) KIF11PTGS2CYP2C9PDPK1PTGS1
SCHEMBL2465743 0.72 PTGS2 (0.55) PTGS2CYP2C9PDPK1PTGS1CA12
SCHEMBL6732634 0.72 PTGS1 (0.61) KIF11PTGS2PTGS1CA12CA1
SCHEMBL6732217 0.71 KIF11 (0.58) KIF11PTGS2CYP2C9PDPK1PTGS1

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 KIF11 3158/4885PTGS2 1289/4885CYP2C9 151/4885

“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.