SCHEMBL9838541

SCHEMBL9838541

CN1C2CCCC1(N)CC2

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 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
SCHEMBL1573637 1.00 MAPK1 (0.31) MAPK1
Hydrochloric Acid SCHEMBL28575505 0.98 MAPK1 (0.30) MAPK1
Hydrochloric Acid SCHEMBL7624938 0.98 MAPK1 (0.30) MAPK1
SCHEMBL7442843 0.95 MAPK1 (0.33) MAPK1
SCHEMBL22388041 0.91
SCHEMBL13676325 0.72
Hydrochloric Acid SCHEMBL28566347 0.71
Hydrochloric Acid SCHEMBL28564693 0.71
SCHEMBL5731681 0.70
SCHEMBL7305562 0.70

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-4985420-A 5-HYDROXYTRYPTAMINE RECEPTOR ANTAGONISTS DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1991-01-15 US disclosed
EP-0350130-A2 New substituted 1,7-annelated 1H-indazoles DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1990-01-10 EP disclosed