SCHEMBL12985672

SCHEMBL12985672

CCOC(=O)Cc1ccc(NCS(C)(=O)=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.59
LMNA P02545 3/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
TSHR P16473 1/20 0.53
HSD17B10 Q99714 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.50
CYP4Z1 Q86W10 1/20 0.48
MEN1 O00255 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
RECQL P46063 1/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
KLK7 P49862 1/20 0.42
TBXAS1 P24557 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPRB P23467 1/20 0.41

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
SCHEMBL11458148 0.83 MAPT (0.67) MAPTLMNAKDM4EALDH1A1TSHR
SCHEMBL5842450 0.82 HPGD (0.63) MAPTLMNAKDM4EALDH1A1TSHR
SCHEMBL7345267 0.81 MAPT (0.65) MAPTLMNAKDM4EALDH1A1TSHR
SCHEMBL11473930 0.80 MAPT (0.63) MAPTLMNAKDM4EALDH1A1TSHR
SCHEMBL12984765 0.80 FFAR1 (0.51) LMNAKDM4EALDH1A1TSHRHSD17B10
SCHEMBL68851 0.79 CYP4Z1 (0.62) MAPTLMNAKDM4EALDH1A1TSHR
SCHEMBL2636023 0.78 MAPT (0.60) MAPTLMNAKDM4EALDH1A1TSHR
SCHEMBL5458743 0.78 MAPT (0.60) MAPTLMNAKDM4EALDH1A1TSHR
SCHEMBL11802177 0.77 MAPT (0.59) MAPTLMNAKDM4EALDH1A1TSHR
SCHEMBL11799007 0.77 MAPT (0.59) MAPTLMNAKDM4EALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2694509-B1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES AS INHIBITORS OF TROPOMYOSIN-RELATED KINASES PFIZER LTD (GB) 2016-05-18 EP disclosed
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
EP-2694509-A1 PYRROLO [2, 3 -D]PYRIMIDINE DERIVATIVES AS INHIBITORS OF TROPOMYOSIN- RELATED KINASES Pfizer Limited (GB) 2014-02-12 EP disclosed
US-20120258950-A1 PYRROLO[2,3-d]PYRIMIDINE TROPOMYSIN-RELATED KINASE INHIBITORS PFIZER LIMITED (GB) 2012-10-11 US disclosed
WO-2012137089-A1 PYRROLO [2, 3 -D] PYRIMIDINE DERIVATIVES AS INHIBITORS OF TROPOMYOSIN- RELATED KINASES PFIZER LIMITED (GB) 2012-10-11 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 (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 MAPT 1597/4885LMNA 2709/4885KDM4E 1866/4885
US-20120258950-A1 PYRROLO[2,3-d]PYRIMIDINE TROPOMYSIN-RELATED KINASE INHIBITORS DMPK, DTYMK, MUSK MAPT 1597/4885LMNA 2709/4885KDM4E 1866/4885

“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.