SCHEMBL13628728

SCHEMBL13628728

CCc1ncc(-c2cnn[nH]2)o1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.31

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
SCHEMBL13628705 0.71 NOTUM (0.30) NOTUM
SCHEMBL13628714 0.69 IDO1 (0.32) NOTUM
SCHEMBL12091036 0.67 FAAH (0.43) NOTUM
SCHEMBL13628747 0.66 MAPT (0.41)
SCHEMBL1696557 0.66 NOTUM (0.68) NOTUM
SCHEMBL6629373 0.63 NOTUM (0.44) NOTUM
SCHEMBL7903330 0.63 NOTUM (0.70) NOTUM
SCHEMBL13848657 0.63 FAAH (0.39) NOTUM
SCHEMBL1617734 0.63 RAB9A (0.51) NOTUM
SCHEMBL11519618 0.62

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-7612070-B2 Heterocyclic compounds as antiinflammatory agents and cyclooxygenase inhibitors CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2009-11-03 US disclosed
US-7612070-B2 Heterocyclic compounds as antiinflammatory agents and cyclooxygenase inhibitors CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2009-11-03 US disclosed