SCHEMBL11468014

SCHEMBL11468014

Cc1ccc(-c2nc(=O)n(CC(F)(F)F)c3ccccc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.56
▸ MAPT P10636 2/20 0.45
▸ NR1I2 O75469 1/20 0.43
▸ EGFR P00533 1/20 0.43
▸ ADRA2A P08913 1/20 0.43
▸ ADORA3 P0DMS8 1/20 0.43
▸ TBXA2R P21731 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ OPRD1 P41143 1/20 0.43
▸ PDE4D Q08499 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ TP53 P04637 2/20 0.42
▸ PTGDR2 Q9Y5Y4 1/20 0.42
▸ P2RX4 Q99571 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
SCHEMBL11162361 0.89 LMNA (0.54) LMNAMAPTPOLBTP53
SCHEMBL11160129 0.85 NR1I2 (0.50) LMNAMAPTNR1I2EGFRADRA2A
SCHEMBL11479043 0.85 NR1I2 (0.59) LMNAMAPTNR1I2EGFRADRA2A
SCHEMBL11635900 0.79 LMNA (0.55) LMNANR1I2EGFRADRA2AADORA3
SCHEMBL11867768 0.76 MAPT (0.40) LMNAMAPTADORA3POLB
SCHEMBL11462895 0.76 MAPT (0.44) LMNAMAPTPOLBTP53PTGDR2
SCHEMBL11861673 0.76 CASR (0.40) LMNAMAPTPOLBTP53
SCHEMBL14347514 0.76 RORA (0.40) LMNAMAPTPTGDR2
SCHEMBL14374207 0.76 MAT2A (0.43) LMNAMAPTPOLBTP53PTGDR2
SCHEMBL11462815 0.76 NR1I2 (0.48) LMNAMAPTNR1I2EGFRADRA2A

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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