SCHEMBL12984764

SCHEMBL12984764

NC(=O)Cc1cc(F)c(F)cc1F

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ RORC P51449 1/20 0.40
▸ DPP4 P27487 6/20 0.39
▸ ICMT O60725 4/20 0.38
▸ HTT P42858 1/20 0.36
▸ CA2 P00918 1/20 0.35
▸ MMP1 P03956 1/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ MMP9 P14780 1/20 0.35
▸ MMP12 P39900 1/20 0.35
▸ DPP7 Q9UHL4 1/20 0.35

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
SCHEMBL29819673 1.00 HDAC1 (0.40) HDAC1HDAC8RORCDPP4ICMT
SCHEMBL28217637 0.84 HDAC1 (0.41) HDAC1HDAC8DPP4CA2MMP1
SCHEMBL24575335 0.84 KDM1A (0.38) HDAC1HDAC8RORCICMTHTT
SCHEMBL4314806 0.84 KIF11 (0.36) HDAC1HDAC8RORCICMTHTT
SCHEMBL28181253 0.84 HDAC1 (0.40) HDAC1HDAC8RORCDPP4MMP1
SCHEMBL16005219 0.81 DGAT1 (0.36) HDAC1HDAC8RORCICMTHTT
SCHEMBL29718812 0.81 ICMT (0.44) ICMT
SCHEMBL28687813 0.79 HDAC1 (0.37) HDAC1HDAC8RORCDPP4MMP1
SCHEMBL332576 0.79 CXCL8 (0.43) HDAC1HDAC8DPP4MMP1MMP2
SCHEMBL29362137 0.79 CXCL8 (0.43) HDAC1HDAC8DPP4MMP1MMP2

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 3 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

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 HDAC1 2579/4885HDAC8 2645/4885RORC 1441/4885
US-20120258950-A1 PYRROLO[2,3-d]PYRIMIDINE TROPOMYSIN-RELATED KINASE INHIBITORS DMPK, DTYMK, MUSK HDAC1 2579/4885HDAC8 2645/4885RORC 1441/4885

“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.

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