SCHEMBL10165639

SCHEMBL10165639

CC(=O)c1cc(C(=O)NCc2ccc(F)c(Cl)c2)n2nc(C(F)(F)F)cc2n1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 9/20 0.44
TRPV1 Q8NER1 2/20 0.44
CNR2 P34972 1/20 0.42
MMP13 P45452 3/20 0.40
DGAT1 O75907 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
PDE4B Q07343 1/20 0.39
PTGER4 P35408 1/20 0.39

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
SCHEMBL8252009 0.92 MAPK1 (0.43) MAPK1TRPV1CNR2MMP13DGAT1
SCHEMBL8255410 0.91 TRPV1 (0.44) MAPK1TRPV1CNR2MMP13DGAT1
SCHEMBL10165685 0.84 MAPK1 (0.46) MAPK1CNR2MMP13DGAT1HDAC3
SCHEMBL10165955 0.78 MMP13 (0.64) MAPK1TRPV1CNR2MMP13DGAT1
SCHEMBL10162467 0.77 MAPK1 (0.43) MAPK1MMP13DGAT1HDAC3HDAC1
SCHEMBL10165461 0.77 MAPK1 (0.46) MAPK1CNR2MMP13DGAT1HDAC3
SCHEMBL10166552 0.76 PHGDH (0.47) MMP13PTGER4
SCHEMBL8256442 0.76 MMP13 (0.67) MAPK1TRPV1CNR2MMP13DGAT1
SCHEMBL10164579 0.76 MAPK1 (0.45) MAPK1CNR2MMP13DGAT1HDAC3
SCHEMBL8187623 0.75 KDM4E (0.48) MMP13PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120015920-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2012-01-19 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 (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-20120015920-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS MMP13, TIMP3, MMP3 MAPK1 2860/4885TRPV1 2157/4885CNR2 2267/4885

“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.