SCHEMBL20068348

SCHEMBL20068348

COC(=O)c1ccc(CCCN(C)C)n2cccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.37
▸ TP53 P04637 1/20 0.37
▸ KMT2A Q03164 4/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ USP2 O75604 1/20 0.36
▸ NR4A2 P43354 2/20 0.36
▸ GAA P10253 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ RAD52 P43351 1/20 0.34
▸ KDM4E B2RXH2 4/20 0.34
▸ ALDH1A1 P00352 4/20 0.34
▸ HPGD P15428 2/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ PABPC1 P11940 1/20 0.34
▸ PPARG P37231 1/20 0.34
▸ NR2E3 Q9Y5X4 1/20 0.34
▸ NCOR2 Q9Y618 1/20 0.34

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
SCHEMBL14957953 0.80 NR4A2 (0.41) MAPTKMT2AMEN1USP2NR4A2
SCHEMBL20068336 0.72 MYC (0.49) MAPTKMT2AMEN1USP2NR4A2
SCHEMBL21354384 0.69 NR4A2 (0.40) MAPTKMT2AMEN1USP2NR4A2
SCHEMBL21354382 0.69 NR4A2 (0.40) MAPTKMT2AMEN1USP2NR4A2
SCHEMBL14958413 0.69 ALDH1A1 (0.46) MAPTKMT2AMEN1USP2NR4A2
SCHEMBL31186050 0.68 ALDH1A1 (0.52) MAPTKMT2ANR4A2GAALMNA
SCHEMBL9353793 0.67 NR4A2 (0.67) MAPTKMT2AMEN1NR4A2GAA
SCHEMBL7347897 0.66 SIGMAR1 (0.43) MAPTTP53KMT2AMEN1GAA
SCHEMBL14958425 0.66 MAPT (0.39) MAPTKMT2AMEN1USP2NR4A2
SCHEMBL14958424 0.66 MAPT (0.39) MAPTKMT2AMEN1USP2NR4A2

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
WO-2018071535-A1 PESTICIDAL AND PARASITICIDAL VINYL ISOXAZOLINE COMPOUNDS MERIAL, INC. (US) 2018-04-19 — — WO disclosed
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