SCHEMBL29882339

SCHEMBL29882339

c1ccc(-c2c[nH]nc2Oc2cc[nH]n2)cc1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SQOR Q9Y6N5 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ AKT1 P31749 1/20 0.32
▸ AKT2 P31751 1/20 0.32
▸ CDC7 O00311 1/20 0.31
▸ PLK4 O00444 1/20 0.31
▸ CHEK1 O14757 1/20 0.31
▸ CHUK O15111 1/20 0.31
▸ PDPK1 O15530 1/20 0.31
▸ DYRK3 O43781 1/20 0.31
▸ ROCK2 O75116 1/20 0.31
▸ PRKD3 O94806 1/20 0.31
▸ MAP4K4 O95819 1/20 0.31
▸ PAK4 O96013 1/20 0.31
▸ NTRK1 P04629 1/20 0.31
▸ PRKCG P05129 1/20 0.31
▸ INSR P06213 1/20 0.31
▸ LCK P06239 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ CDK1 P06493 1/20 0.31

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
SCHEMBL6971232 0.84 AKT1 (0.39) SQORALDH1A1AKT1AKT2CDC7
SCHEMBL29360772 0.78 KDM4E (0.38) ALDH1A1MAPK1ALOX15
SCHEMBL1384959 0.73 SQOR (0.51) SQORALDH1A1AKT1AKT2CDC7
SCHEMBL25274257 0.70 METAP2 (0.43) SQORALDH1A1AKT1AKT2CDC7
SCHEMBL207642 0.70 HAO1 (0.53) ALDH1A1MAPK1
SCHEMBL1386288 0.69 NPC1 (0.35) SQORALDH1A1AKT1AKT2CDC7
SCHEMBL10432295 0.69 ALDH1A1 (0.39) ALDH1A1
SCHEMBL3263121 0.69 MAPK1 (0.43) SQORALDH1A1CDC7PLK4CHEK1
SCHEMBL1386673 0.68 SQOR (0.49) SQORALDH1A1CDC7CDK1CDK2
SCHEMBL2554756 0.68 ALDH1A1 (0.30) ALDH1A1AKT1AKT2

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-20220272979-A1 HERBICIDAL COMBINATION UPL DO BRASIL INDUSTRIA E COMERCIO DE INSUMOS AGROPECUARIOS S.A. (BR) 2022-09-01 — — US disclosed
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