SCHEMBL10165582

SCHEMBL10165582

CC(=O)c1cc(C(=O)NCc2ccc(F)c(Cl)c2)nc2c(Cl)cnn12

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
MMP13 P45452 4/20 0.43
MAPK1 P28482 13/20 0.43
ADAMTS4 O75173 1/20 0.42
MMP3 P08254 1/20 0.42
CYP1A1 P04798 1/20 0.42
HPGD P15428 1/20 0.42
RPS6KA1 Q15418 1/20 0.42
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL10165476 0.94 MMP13 (0.48) HDAC3HDAC1HDAC2HDAC6MMP13
SCHEMBL8247704 0.91 MMP13 (0.45) HDAC3HDAC1HDAC2HDAC6MMP13
SCHEMBL8256400 0.90 MAPK1 (0.42) HDAC3HDAC1HDAC2HDAC6MMP13
SCHEMBL10165461 0.85 MAPK1 (0.46) HDAC3HDAC1HDAC2HDAC6MMP13
SCHEMBL4255252 0.85 MMP13 (0.50) HDAC3HDAC1HDAC2HDAC6MMP13
SCHEMBL8252066 0.84 MMP13 (0.47) HDAC3HDAC1HDAC2HDAC6MMP13
SCHEMBL10165604 0.84 MMP13 (0.46) HDAC3HDAC1HDAC2HDAC6MMP13
SCHEMBL10162418 0.84 MMP13 (0.50) HDAC3HDAC1HDAC2HDAC6MMP13
SCHEMBL10167899 0.82 MMP13 (0.49) MMP13MAPK1ADAMTS4MMP3CYP1A1
SCHEMBL10162378 0.81 MMP13 (0.45) MMP13MAPK1ADAMTS4MMP3RPS6KA1

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 HDAC3 80/4885HDAC1 104/4885HDAC2 126/4885

“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.