SCHEMBL11462895

SCHEMBL11462895

O=c1nc(-c2ccccc2)c2cc(F)ccc2n1CC(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.44
▸ LMNA P02545 2/20 0.44
▸ PTGDR2 Q9Y5Y4 2/20 0.43
▸ TP53 P04637 2/20 0.43
▸ PTGER1 P34995 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ CYP11B2 P19099 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.40
▸ POLB P06746 1/20 0.40

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
SCHEMBL11477554 0.86 MAPT (0.44) MAPTLMNATP53RXFP1POLB
Fluquazone SCHEMBL43464 0.86 MAPT (0.58) MAPTLMNATP53RXFP1
SCHEMBL11160129 0.86 NR1I2 (0.50) MAPTLMNAPTGDR2TP53
SCHEMBL11460555 0.86 MAPT (0.53) MAPTLMNATP53PTGER1
SCHEMBL11162361 0.85 LMNA (0.54) MAPTLMNATP53RXFP1POLB
SCHEMBL11160051 0.83 CASR (0.59) MAPTLMNAPTGDR2TP53
SCHEMBL11163429 0.82 L3MBTL1 (0.53) MAPTLMNAPOLB
SCHEMBL11638587 0.81 PLK1 (0.46) MAPTLMNATP53PTGER1RXFP1
SCHEMBL11459543 0.80 PDE3B (0.47) MAPTLMNATP53
SCHEMBL11479018 0.79 RXFP1 (0.51) MAPTLMNATP53RXFP1

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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