SCHEMBL14073111

SCHEMBL14073111

O=C1COc2ccc(CNC(=O)c3cc(-c4ccccc4)cs3)cc2N1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 4/20 0.57
▸ MMP8 P22894 5/20 0.55
▸ MMP13 P45452 5/20 0.55
▸ MMP12 P39900 3/20 0.55
▸ TSHR P16473 1/20 0.55
▸ MAOA P21397 1/20 0.54
▸ ALDH1A1 P00352 2/20 0.48
▸ KMT2A Q03164 2/20 0.45
▸ MAPT P10636 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ DRD2 P14416 1/20 0.45
▸ DRD4 P21917 1/20 0.45
▸ DRD3 P35462 1/20 0.45

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
SCHEMBL14073454 0.83 KMT2A (0.64) PARP1ALDH1A1KMT2AMAPT
SCHEMBL14073191 0.83 HPGD (0.64) PARP1MMP8MMP13TSHRMAOA
SCHEMBL14073279 0.78 HPGD (0.64) PARP1MMP8MMP13MMP12TSHR
SCHEMBL14072985 0.78 TSHR (0.85) PARP1MMP8MMP13TSHRMAOA
SCHEMBL14073380 0.77 TSHR (0.56) PARP1MMP8MMP13TSHRMAOA
SCHEMBL13344301 0.77 MMP13 (0.82) PARP1MMP8MMP13MAOA
SCHEMBL14072283 0.77 MMP8 (0.60) PARP1MMP8MMP13TSHRMAOA
SCHEMBL14073682 0.77 KMT2A (0.53) ALDH1A1KMT2AMAPT
SCHEMBL13344268 0.77 MMP13 (0.82) PARP1MMP8MMP13MAOA
SCHEMBL14073204 0.76 TSHR (0.66) PARP1MMP8MMP13TSHRMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 — — US disclosed
US-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 — — 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 (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-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety MMP12, MMP13, MMP25 PARP1 327/4885MMP8 28/4885MMP13 2/4885

“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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