SCHEMBL11606905

SCHEMBL11606905

CC(C)n1c(=O)nc(-c2ccccc2)c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 13/20 0.61
▸ KMT2A Q03164 2/20 0.60
▸ MEN1 O00255 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.59
▸ NR1I2 O75469 1/20 0.58
▸ EGFR P00533 1/20 0.58
▸ ADRA2A P08913 1/20 0.58
▸ ADORA3 P0DMS8 1/20 0.58
▸ TBXA2R P21731 1/20 0.58
▸ PTGS2 P35354 1/20 0.58
▸ OPRD1 P41143 1/20 0.58
▸ PDE4D Q08499 1/20 0.58
▸ OPRK1 P41145 1/20 0.51
▸ MAPT P10636 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ CYP19A1 P11511 1/20 0.46

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
SCHEMBL13347118 0.88 CASR (0.68) CASRKMT2AMEN1
SCHEMBL13347519 0.86 CASR (0.67) CASRKMT2AMEN1
SCHEMBL11862638 0.85 L3MBTL1 (0.51) CASRKMT2AMEN1L3MBTL1NR1I2
SCHEMBL11547536 0.84 L3MBTL1 (0.50) CASRKMT2AMEN1L3MBTL1NR1I2
SCHEMBL11606364 0.84 L3MBTL1 (0.67) KMT2AMEN1L3MBTL1EGFROPRK1
SCHEMBL11604828 0.81 KMT2A (0.60) KMT2AMEN1L3MBTL1OPRK1MAPT
SCHEMBL11544376 0.80 L3MBTL1 (0.46) CASRKMT2AMEN1L3MBTL1NR1I2
SCHEMBL11542801 0.80 L3MBTL1 (0.46) CASRKMT2AMEN1L3MBTL1NR1I2
SCHEMBL11601877 0.80 CASR (0.67) CASRNR1I2EGFRADRA2AADORA3
SCHEMBL7680445 0.79 NR1I2 (0.72) CASRKMT2ANR1I2EGFRADRA2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4096144-A Process for preparing quinazolinone derivatives and their 2-(N-mono-substituted amino)-phenyl ketone intermediate derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1978-06-20 — — US disclosed
US-4067868-A Production of quinazolinone compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1978-01-10 — — US disclosed
US-3953446-A Process for preparing quinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-04-27 — — US disclosed
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