SCHEMBL17453571

SCHEMBL17453571

CO[C@H]1C[C@@H](N=[N+]=[N-])CC[C@]1(C)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.35
ANPEP P15144 1/20 0.35
PAX8 Q06710 1/20 0.30

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
SCHEMBL17440291 1.00 MMP2 (0.35) MMP2ANPEPPAX8
SCHEMBL17440285 1.00 MMP2 (0.35) MMP2ANPEPPAX8
SCHEMBL17440309 0.73 NR1H4 (0.32) PAX8
SCHEMBL17440249 0.73 NR1H4 (0.32) PAX8
SCHEMBL17440235 0.73 NR1H4 (0.32) PAX8
SCHEMBL17440292 0.73
SCHEMBL23459320 0.72 FFAR3 (0.46) MMP2ANPEP
SCHEMBL23459427 0.68 MMP2 (0.39) MMP2ANPEP
SCHEMBL8969379 0.68 POLA1 (0.37) MMP2
SCHEMBL15657394 0.67 MMP2 (0.38) MMP2ANPEP

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-9908895-B2 Tricyclic fused thiophene derivatives as JAK inhibitors INCYTE CORPORATION (US) 2018-03-06 US disclosed
US-20160024109-A1 TRICYCLIC FUSED THIOPHENE DERIVATIVES AS JAK INHIBITORS INCYTE HOLDINGS CORPORATION 2016-01-28 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-20160024109-A1 TRICYCLIC FUSED THIOPHENE DERIVATIVES AS JAK INHIBITORS JAK1, JAK3, JAK2 MMP2 4345/4885ANPEP 1425/4885PAX8 4178/4885

“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.