SCHEMBL8202010

SCHEMBL8202010

O=C(O)c1nc2ccc(F)c(F)c2c(=O)[nH]1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 12/20 0.55
PARP1 P09874 2/20 0.50
TNKS O95271 1/20 0.50
TNKS2 Q9H2K2 1/20 0.50
PIN1 Q13526 2/20 0.45
MMP10 P09238 4/20 0.39
MMP8 P22894 4/20 0.39
TYMS P04818 2/20 0.38

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
SCHEMBL27683279 0.85 PIN1 (0.43) MMP13PARP1TNKSTNKS2PIN1
SCHEMBL8204538 0.81 PARP1 (0.60) MMP13PARP1TNKSTNKS2PIN1
SCHEMBL688942 0.79 MMP13 (0.56) MMP13PARP1TNKSTNKS2MMP10
SCHEMBL20339664 0.76 PARP1 (0.57) MMP13PARP1TNKSTNKS2
SCHEMBL29903044 0.76 PARP1 (0.57) MMP13PARP1TNKSTNKS2
SCHEMBL15840736 0.76 PARP1 (0.66) MMP13PARP1TNKSTNKS2TYMS
SCHEMBL26018100 0.76 PARP1 (0.50) MMP13PARP1TNKSTNKS2TYMS
SCHEMBL4937745 0.75 MMP13 (0.74) MMP13MMP10MMP8
SCHEMBL8198164 0.74 PIN1 (0.44) MMP13PIN1TYMS
SCHEMBL8198412 0.73 TUBB4A (0.52) PARP1TNKSTNKS2PIN1TYMS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7713966-B2 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2010-05-11 US disclosed
US-7713966-B2 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2010-05-11 US disclosed
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors GEGE CHRISTIAN 2008-10-23 US disclosed
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors GEGE CHRISTIAN 2008-10-23 US disclosed
WO-2008063668-A1 HETEROBICYCLIC METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2008-05-29 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 (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-20080261968-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 MMP13 1/4885PARP1 156/4885TNKS 977/4885

“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.