SCHEMBL8192214

SCHEMBL8192214

O=C1C[C@H](C(=O)NCc2ccc3c(c2)NC(=O)CO3)NC(=O)N1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.53
▸ PARP1 P09874 3/20 0.53
▸ MAOA P21397 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ MMP8 P22894 5/20 0.46
▸ MMP13 P45452 5/20 0.46
▸ GAA P10253 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ TP53 P04637 1/20 0.43
▸ POLB P06746 1/20 0.42

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
SCHEMBL14072944 1.00 TSHR (0.53) TSHRPARP1MAOASMN1; SMN2KMT2A
SCHEMBL14073142 0.93 TSHR (0.57) TSHRPARP1MAOASMN1; SMN2KMT2A
SCHEMBL14073181 0.87 TSHR (0.53) TSHRPARP1MAOASMN1; SMN2KMT2A
SCHEMBL14072945 0.84 SMN1; SMN2 (0.69) TSHRPARP1MAOASMN1; SMN2KMT2A
SCHEMBL14073146 0.82 SMN1; SMN2 (0.61) TSHRPARP1MAOASMN1; SMN2KMT2A
SCHEMBL14073367 0.82 TSHR (0.53) TSHRPARP1MAOASMN1; SMN2KMT2A
SCHEMBL14073557 0.81 TRPV1 (0.56) KMT2AALDH1A1MAPT
SCHEMBL14073184 0.78 PARP1 (0.55) TSHRPARP1MAOASMN1; SMN2KMT2A
SCHEMBL8198652 0.78 PARP1 (0.57) TSHRPARP1MAOASMN1; SMN2KMT2A
SCHEMBL14073116 0.77 PARP1 (0.62) TSHRPARP1MAOAKMT2AMMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008109180-A2 METALLOPROTEASE INHIBITORS CONTAINING A HETEROCYCLIC MOIETY ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2008-09-12 — — WO disclosed
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 TSHR 4343/4885PARP1 327/4885MAOA 137/4885

“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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