SCHEMBL9108524

SCHEMBL9108524

NC(=O)Cc1ccc(SC(F)(F)F)cc1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPRZ1 P23471 4/20 0.61
CA2 P00918 1/20 0.52
PTPN1 P18031 2/20 0.52
KIF11 P52732 1/20 0.50
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
EPHX2 P34913 1/20 0.46
NR1H4 Q96RI1 1/20 0.46
LMNA P02545 1/20 0.42
HTT P42858 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
SCHEMBL963353 0.83 PTPRZ1 (0.63) PTPRZ1CA2PTPN1KIF11ALDH1A1
SCHEMBL13169964 0.81 PTPRZ1 (0.61) PTPRZ1PTPN1KIF11ALDH1A1KDM4E
SCHEMBL933965 0.81 PTPRZ1 (0.49) PTPRZ1PTPN1KIF11ALDH1A1KDM4E
Ethane SCHEMBL11401460 0.80 PTPRZ1 (0.59) PTPRZ1CA2PTPN1ALDH1A1KDM4E
SCHEMBL12986139 0.80 LMNA (0.42) PTPRZ1CA2KIF11ALDH1A1KDM4E
SCHEMBL10655795 0.79 PTPRZ1 (0.58) PTPRZ1PTPN1KIF11ALDH1A1KDM4E
SCHEMBL13946807 0.77 PTPRZ1 (0.60) PTPRZ1PTPN1KIF11ALDH1A1KDM4E
SCHEMBL11290860 0.77 CA2 (0.80) CA2ALDH1A1KDM4E
SCHEMBL30311965 0.76 CA2 (0.46) PTPRZ1CA2KIF11ALDH1A1KDM4E
SCHEMBL933962 0.75 PTPRZ1 (0.47) PTPRZ1PTPN1KIF11ALDH1A1KDM4E

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-20140364415-A1 PYRROLO[2,3-d]PYRIMIDINE TROPOMYSIN-RELATED KINASE INHIBITORS PFIZER LIMITED (GB) 2014-12-11 US disclosed
US-8846698-B2 Pyrrolo[2,3-d]pyrimidine tropomysin-related kinase inhibitors PFIZER LIMITED (US) 2014-09-30 US disclosed
US-20120258950-A1 PYRROLO[2,3-d]PYRIMIDINE TROPOMYSIN-RELATED KINASE INHIBITORS PFIZER LIMITED (GB) 2012-10-11 US disclosed
EP-2459569-A1 INSECTICIDAL 4-AMINO-THIENO[2,3-D]-PYRIMIDINE COMPOUNDS AND METHODS OF THEIR USE Merial Limited (US) 2012-06-06 EP disclosed
US-4822903-A Fluorinated silica catalyst and preparation of aromatic/aliphatic nitriles in the presence thereof RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1989-04-18 US disclosed
US-4504595-A Fluorinated silica catalyst and preparation of aromatic/aliphatic nitriles in the presence thereof RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1985-03-12 US disclosed
US-4438042-A FROM AMIDES, FLUORINATE SILCEOUS CATALYSTS RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1984-03-20 US disclosed
US-4436669-A CYANATION, DECARBONYLATION, ACID CATALYSTS RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1984-03-13 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 (2 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-20140364415-A1 PYRROLO[2,3-d]PYRIMIDINE TROPOMYSIN-RELATED KINASE INHIBITORS DMPK, DTYMK, MUSK PTPRZ1 1024/4885CA2 3769/4885PTPN1 807/4885
US-20120258950-A1 PYRROLO[2,3-d]PYRIMIDINE TROPOMYSIN-RELATED KINASE INHIBITORS DMPK, DTYMK, MUSK PTPRZ1 1024/4885CA2 3769/4885PTPN1 807/4885

“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.