SCHEMBL11607181

SCHEMBL11607181

CC(C)n1c(=O)nc(-c2ccccc2)c2cc(C(F)(F)F)ccc21

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 18/20 0.63
▸ NR1I2 O75469 1/20 0.59
▸ EGFR P00533 1/20 0.59
▸ ADRA2A P08913 1/20 0.59
▸ ADORA3 P0DMS8 1/20 0.59
▸ TBXA2R P21731 1/20 0.59
▸ PTGS2 P35354 1/20 0.59
▸ OPRD1 P41143 1/20 0.59
▸ PDE4D Q08499 1/20 0.59

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
SCHEMBL11608433 0.84 FNTA (0.48) CASRNR1I2EGFRADRA2AADORA3
SCHEMBL11601877 0.81 CASR (0.67) CASRNR1I2EGFRADRA2AADORA3
SCHEMBL11634768 0.81 MAPT (0.53) —
SCHEMBL7680445 0.80 NR1I2 (0.72) CASRNR1I2EGFRADRA2AADORA3
SCHEMBL11164263 0.79 CASR (0.95) CASRNR1I2EGFRADRA2AADORA3
SCHEMBL11161844 0.79 CASR (0.64) CASRNR1I2EGFRADRA2AADORA3
SCHEMBL11421197 0.78 NR1I2 (0.74) CASRNR1I2EGFRADRA2AADORA3
SCHEMBL11460555 0.78 MAPT (0.53) —
SCHEMBL11606905 0.77 CASR (0.61) CASRNR1I2EGFRADRA2AADORA3
SCHEMBL3523418 0.76 NR1I2 (0.62) CASRNR1I2EGFRADRA2AADORA3

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-4067868-A Production of quinazolinone compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1978-01-10 — — US disclosed
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