SCHEMBL8188310

SCHEMBL8188310

Cn1c(C(=O)NCc2ccc3c(c2)NC(=O)CO3)nc2ccccc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MMP8 P22894 5/20 0.55
▸ MMP13 P45452 5/20 0.55
▸ PARP1 P09874 3/20 0.53
▸ TSHR P16473 1/20 0.52
▸ MAOA P21397 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ MAPT P10636 3/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48
▸ HTR1A P08908 5/20 0.47
▸ HTR1D P28221 5/20 0.47
▸ HTR1B P28222 4/20 0.47
▸ SLC6A4 P31645 3/20 0.47
▸ DRD2 P14416 1/20 0.47
▸ HTR2A P28223 1/20 0.47
▸ HTR2C P28335 1/20 0.47
▸ HTR2B P41595 1/20 0.47
▸ KCNH2 Q12809 1/20 0.47
▸ LMNA P02545 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46

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
SCHEMBL13344173 0.89 PARP1 (0.53) MMP8MMP13PARP1TSHRMAOA
SCHEMBL8200915 0.82 TSHR (0.47) MMP8MMP13PARP1TSHRMAOA
SCHEMBL14073152 0.80 TSHR (0.59) MMP8MMP13PARP1TSHRMAOA
SCHEMBL13344138 0.80 MMP13 (0.66) MMP8MMP13PARP1TSHRMAOA
SCHEMBL14124338 0.80 PARP1 (0.55) MMP8MMP13PARP1TSHRMAOA
SCHEMBL8180501 0.79 MAPT (0.55) MMP8MMP13PARP1TSHRMAOA
SCHEMBL14073252 0.79 TSHR (0.54) MMP8MMP13PARP1TSHRMAOA
SCHEMBL14073306 0.78 USP2 (0.59) MMP8MMP13PARP1TSHRMAOA
SCHEMBL14073299 0.78 TSHR (0.58) MMP8MMP13PARP1TSHRMAOA
SCHEMBL14073344 0.77 TSHR (0.55) MMP8MMP13PARP1TSHRMAOA

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 MMP8 5/4885MMP13 1/4885PARP1 156/4885

“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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