SCHEMBL19987539

SCHEMBL19987539

Cc1cc(-c2cc(C)n(C)n2)ccc1OCc1ccccc1N(N)C(=O)N(C)N

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 6/20 0.35
MRGPRX4 Q96LA9 4/20 0.35
FFAR4 Q5NUL3 4/20 0.34
FFAR1 O14842 2/20 0.34
S1PR1 P21453 1/20 0.34
S1PR5 Q9H228 1/20 0.34
PTGER1 P34995 4/20 0.33

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
SCHEMBL23506193 0.85 MRGPRX4 (0.38) CD274MRGPRX4FFAR4FFAR1
SCHEMBL19987560 0.82 CD274 (0.35) CD274MRGPRX4FFAR4FFAR1S1PR1
SCHEMBL18831169 0.79 MRGPRX4 (0.36) CD274MRGPRX4FFAR4FFAR1S1PR1
SCHEMBL19987597 0.75 SMN1; SMN2 (0.43) CD274MRGPRX4FFAR4FFAR1
SCHEMBL18831230 0.75 MRGPRX4 (0.34) CD274MRGPRX4PTGER1
SCHEMBL16273636 0.74 MRGPRX4 (0.34) CD274MRGPRX4FFAR4FFAR1S1PR1
SCHEMBL23506206 0.74 FFAR4 (0.42) CD274FFAR4FFAR1
SCHEMBL23506230 0.74 MRGPRX4 (0.40) CD274MRGPRX4FFAR1
SCHEMBL18831177 0.73 MRGPRX4 (0.33) CD274MRGPRX4FFAR4FFAR1S1PR1
SCHEMBL18831272 0.73 MRGPRX4 (0.33) MRGPRX4

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-3006440-B1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME SUMITOMO CHEMICAL CO (JP) 2018-03-21 EP disclosed