SCHEMBL11723933

SCHEMBL11723933

Cc1ccc2c(-c3ccc(Cl)cc3)nc(=O)n(C(C)C)c2c1

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.77
EGFR P00533 1/20 0.77
ADRA2A P08913 1/20 0.77
ADORA3 P0DMS8 1/20 0.77
TBXA2R P21731 1/20 0.77
PTGS2 P35354 1/20 0.77
OPRD1 P41143 1/20 0.77
PDE4D Q08499 1/20 0.77
CASR P41180 19/20 0.52

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
SCHEMBL11565990 0.92 NR1I2 (0.85) NR1I2EGFRADRA2AADORA3TBXA2R
Fluproquazone SCHEMBL29363976 0.87 NR1I2 (0.77) NR1I2EGFRADRA2AADORA3TBXA2R
Fluproquazone SCHEMBL26210 0.87 NR1I2 (0.77) NR1I2EGFRADRA2AADORA3TBXA2R
Proquazone SCHEMBL25341 0.87 NR1I2 (1.00) NR1I2EGFRADRA2AADORA3TBXA2R
Proquazone SCHEMBL29508590 0.87 NR1I2 (1.00) NR1I2EGFRADRA2AADORA3TBXA2R
Proquazone SCHEMBL2931942 0.86 NR1I2 (0.97) NR1I2EGFRADRA2AADORA3TBXA2R
SCHEMBL11734288 0.83 NR1I2 (0.54) NR1I2EGFRADRA2AADORA3TBXA2R
SCHEMBL11608840 0.81 NR1I2 (0.67) NR1I2EGFRADRA2AADORA3TBXA2R
SCHEMBL13347126 0.80 CASR (0.76) NR1I2EGFRADRA2AADORA3TBXA2R
SCHEMBL11605525 0.79 NR1I2 (0.76) NR1I2EGFRADRA2AADORA3TBXA2R

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
US-4064246-A ANTIINFLAMMATORY AGENTS SANDOZ, INC. (US) 1977-12-20 US disclosed