SCHEMBL17942999

SCHEMBL17942999

CNCCCCCCCCCN=[N+]=[N-]

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 1/20 0.44
▸ SIGMAR1 Q99720 2/20 0.33
▸ MAN2B1 O00754 1/20 0.33
▸ IDUA P35475 1/20 0.31
▸ L3MBTL1 Q9Y468 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
SCHEMBL13569663 1.00 EPHX1 (0.44) EPHX1SIGMAR1MAN2B1IDUAL3MBTL1
SCHEMBL30380341 1.00 EPHX1 (0.44) EPHX1SIGMAR1MAN2B1IDUAL3MBTL1
SCHEMBL26021948 1.00 EPHX1 (0.44) EPHX1SIGMAR1MAN2B1IDUAL3MBTL1
SCHEMBL20860376 0.98 — —
SCHEMBL13554462 0.90 — —
Hydrochloric Acid SCHEMBL16087497 0.88 — —
SCHEMBL13589429 0.79 — —
SCHEMBL13667314 0.79 — —
SCHEMBL13569668 0.79 IDUA (0.38) IDUA
SCHEMBL16852226 0.79 IDUA (0.38) IDUA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160213786-A1 PROTEIN-ACTIVE AGENT CONJUGATES AND METHODS OF USE LEGOCHEM BIOSCIENCES, INC. (KR) 2016-07-28 — — 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-20160213786-A1 PROTEIN-ACTIVE AGENT CONJUGATES AND METHODS OF USE FNTA, FCGRT, GGT1 EPHX1 723/4885SIGMAR1 4507/4885MAN2B1 1549/4885

“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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