SCHEMBL9364504

SCHEMBL9364504

O=C(CBr)Nc1nnn[nH]1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.35

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
SCHEMBL5143980 0.82 GLS (0.33)
SCHEMBL5143978 0.82
SCHEMBL10225946 0.81 LMNA (0.43)
SCHEMBL11683324 0.81 PRMT1 (0.37)
SCHEMBL13411791 0.79 ALPL (0.36) ADORA1
SCHEMBL9129001 0.78 CYP2C19 (0.46) ADORA1
SCHEMBL15500193 0.78 BCHE (0.46)
SCHEMBL12057465 0.77 MDM2 (0.33)
SCHEMBL9128672 0.77 CYP2C19 (0.45) ADORA1
SCHEMBL10652900 0.75

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
EP-0419676-B1 THIONAPHTHALENE DERIVATIVES, METHOD OF PRODUCING THE SAME, AND ANTIALLERGIC AGENT CONTAINING THE SAME TEIJIN LTD (JP) 1994-12-07 EP disclosed
EP-0419676-A1 THIONAPHTHALENE DERIVATIVES, METHOD OF PRODUCING THE SAME, AND ANTIALLERGIC AGENT CONTAINING THE SAME TEIJIN LIMITED (JP) 1991-04-03 EP disclosed