SCHEMBL21092017

SCHEMBL21092017

CNC(C)(C)C1CCCCCC(C)(I)CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 2/20 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
SCHEMBL14639632 0.78 SSTR4 (0.41) SSTR4
SCHEMBL24761927 0.78 SSTR4 (0.41) SSTR4
SCHEMBL26353635 0.78 SSTR4 (0.41) SSTR4
SCHEMBL23768708 0.76 SSTR4 (0.33) SSTR4
SCHEMBL18594511 0.72 ALDH1A1 (0.31)
SCHEMBL13783236 0.69 ALDH1A1 (0.39)
SCHEMBL23608072 0.69 ALDH1A1 (0.39)
SCHEMBL13609726 0.68
SCHEMBL172691 0.68
SCHEMBL18373104 0.68

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
EP-3191568-B1 USES OF CONTROLLING PARTICULATE EMISSIONS IN AN INTERNAL COMBUSTION ENGINE BP OIL INT (GB) 2019-06-12 EP disclosed