SCHEMBL11634049

SCHEMBL11634049

CCn1c(=O)nc(-c2ccccc2)c2cc(C)ccc21

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 1/20 0.54
▸ EGFR P00533 1/20 0.54
▸ ADRA2A P08913 1/20 0.54
▸ ADORA3 P0DMS8 1/20 0.54
▸ TBXA2R P21731 1/20 0.54
▸ PTGS2 P35354 1/20 0.54
▸ OPRD1 P41143 1/20 0.54
▸ PDE4D Q08499 1/20 0.54
▸ NLRP3 Q96P20 1/20 0.53
▸ MAPT P10636 5/20 0.53
▸ TP53 P04637 3/20 0.53
▸ LMNA P02545 5/20 0.52
▸ PGR P06401 1/20 0.47
▸ RORA P35398 1/20 0.47
▸ RORC P51449 1/20 0.47
▸ RORB Q92753 1/20 0.47
▸ NPY5R Q15761 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 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
SCHEMBL11157753 0.85 MAPT (0.61) MAPTTP53LMNAKDM4EALDH1A1
SCHEMBL11636375 0.85 MAPT (0.47) NR1I2EGFRADRA2AADORA3TBXA2R
SCHEMBL11160129 0.85 NR1I2 (0.50) NR1I2EGFRADRA2AADORA3TBXA2R
SCHEMBL11415911 0.84 LMNA (0.57) MAPTTP53LMNAKDM4EALDH1A1
SCHEMBL11635741 0.84 NR1I2 (0.49) NR1I2EGFRADRA2AADORA3TBXA2R
SCHEMBL11637290 0.83 MAPT (0.46) MAPTTP53LMNA
SCHEMBL11462815 0.83 NR1I2 (0.48) NR1I2EGFRADRA2AADORA3TBXA2R
SCHEMBL11634768 0.82 MAPT (0.53) MAPTTP53LMNAPGRRORA
SCHEMBL11610757 0.82 NR1I2 (0.58) NR1I2EGFRADRA2AADORA3TBXA2R
SCHEMBL11604828 0.81 KMT2A (0.60) MAPTLMNAALDH1A1

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-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
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