SCHEMBL29695283

SCHEMBL29695283

CCn1nc(Cl)c(O)c(-c2c(C)ccc3ccc(C)cc23)c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.37
▸ ALDH1A1 P00352 3/20 0.34
▸ HTT P42858 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ MITF O75030 1/20 0.34
▸ S1PR4 O95977 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ S1PR1 P21453 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ TP53 P04637 2/20 0.33
▸ ATM Q13315 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ NQO1 P15559 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32

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
SCHEMBL21835397 0.84 MEN1 (0.33) KMT2AALDH1A1HTTMAPTRAB9A
SCHEMBL29443524 0.84 MEN1 (0.33) KMT2AALDH1A1HTTMAPTRAB9A
SCHEMBL25184883 0.75 MAPK8 (0.37) KMT2AHTTLMNAMEN1RXFP1
SCHEMBL29058918 0.74 MEN1 (0.34) KMT2AALDH1A1HTTMAPTRAB9A
SCHEMBL30834467 0.73 TSHR (0.38) KMT2AHTTLMNATP53POLB
SCHEMBL25202984 0.71 HPGD (0.38) KMT2AMAPTRAB9AMEN1L3MBTL1
SCHEMBL21835493 0.68 NPBWR1 (0.35) KMT2AALDH1A1HTTMAPTRAB9A
SCHEMBL29386231 0.68 NPBWR1 (0.35) KMT2AALDH1A1HTTMAPTRAB9A
SCHEMBL28612147 0.67 ALDH1A1 (0.39) KMT2AALDH1A1HTTMAPTRAB9A
SCHEMBL28613788 0.67 CYP1A2 (0.34) KMT2AALDH1A1MAPTLMNAMEN1

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
EP-3999492-A1 HERBICIDAL COMPOUNDS Syngenta Crop Protection AG (CH) 2022-05-25 — — EP disclosed
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