SCHEMBL9252467

SCHEMBL9252467

CN(c1ccccc1)c1ccc(C=O)c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.42
CHKA P35790 4/20 0.40
EGFR P00533 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
PDE5A O76074 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
RET P07949 1/20 0.37
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.35
BLM P54132 1/20 0.35
ALDH1A1 P00352 1/20 0.35
IMPDH2 P12268 1/20 0.35
MCL1 Q07820 1/20 0.35

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
SCHEMBL9249886 0.84 MEN1 (0.39) TOP2AMEN1KMT2ATDP1RET
SCHEMBL346454 0.82 CHEK1 (0.52) MEN1KMT2ATDP1RETLMNA
SCHEMBL29708057 0.82 CHEK1 (0.52) MEN1KMT2ATDP1RETLMNA
SCHEMBL279082 0.80 CHKA (0.41) CHKAEGFRMEN1KMT2APDE5A
SCHEMBL9251613 0.79 APAF1 (0.40) EGFRTDP1ALDH1A1
SCHEMBL10695407 0.78 KMT2A (0.46) TOP2ACHKAEGFRMEN1KMT2A
SCHEMBL9101634 0.76 TDP1 (0.37) MEN1KMT2ATDP1RETLMNA
SCHEMBL20109430 0.75 SMN1; SMN2 (0.44) CHKAEGFRMEN1KMT2ATDP1
SCHEMBL11521967 0.75 ALDH1A3 (0.45) MEN1KMT2ATDP1RETLMNA
SCHEMBL9249935 0.74 NR3C2 (0.38) MEN1KMT2ATDP1LMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5395969-A Charge transport or control agents; photoconductors; electrographic toners ZENECA LIMITED (GB) 1995-03-07 US disclosed
US-5278315-A Phenylaminonaphthalyl hydrazone IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-01-11 US disclosed