SCHEMBL11479018

SCHEMBL11479018

O=c1nc(-c2ccccc2)c2ccc(Cl)cc2n1CC(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.51
▸ MAPT P10636 7/20 0.47
▸ TP53 P04637 4/20 0.47
▸ LMNA P02545 3/20 0.47
▸ KDM4E B2RXH2 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ MCHR1 Q99705 1/20 0.42
▸ NR1I2 O75469 2/20 0.42
▸ ADORA3 P0DMS8 2/20 0.42
▸ EGFR P00533 1/20 0.42

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
Fluquazone SCHEMBL43464 0.90 MAPT (0.58) RXFP1MAPTTP53LMNAKCNH2
SCHEMBL11479043 0.85 NR1I2 (0.59) RXFP1MAPTTP53LMNAKDM4E
SCHEMBL11162361 0.84 LMNA (0.54) RXFP1MAPTTP53LMNA
Fluquazone SCHEMBL28193448 0.84 MAPT (0.57) RXFP1MAPTTP53LMNAKDM4E
SCHEMBL11468901 0.82 CASR (0.51) MAPTTP53LMNANR1I2ADORA3
SCHEMBL11480424 0.82 MAPT (0.57) RXFP1MAPTTP53LMNAKDM4E
SCHEMBL11470963 0.82 MAPT (0.57) RXFP1MAPTTP53LMNAKDM4E
SCHEMBL11468011 0.81 MAPT (0.56) RXFP1MAPTTP53LMNAKDM4E
SCHEMBL11632380 0.80 RXFP1 (0.48) RXFP1MAPTTP53LMNAKDM4E
SCHEMBL11460777 0.80 MAPT (0.42) RXFP1MAPTTP53LMNAKDM4E

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-4202895-A 1-Polyhaloalkyl-2(1H)-quinazolinone derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-05-13 — — US disclosed
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