SCHEMBL10509074

SCHEMBL10509074

C#COc1c(C)cc(Cl)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.38
▸ TDP1 Q9NUW8 3/20 0.36
▸ MRGPRX4 Q96LA9 1/20 0.36
▸ RAPGEF4 Q8WZA2 1/20 0.36
▸ SCN4A P35499 4/20 0.36
▸ HPGD P15428 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ ALDH1A1 P00352 4/20 0.33
▸ POLB P06746 2/20 0.33
▸ ALOX12 P18054 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33

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
SCHEMBL9349276 0.85 CA1 (0.40) TDP1HPGDCA1CA2CA9
SCHEMBL10510118 0.74 MAPT (0.50) MAPTL3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL10510114 0.72 MAPT (0.41) MAPTL3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL11037554 0.71 CYP2A6 (0.44) L3MBTL1SMN1; SMN2KDM4EHPGDNPSR1
SCHEMBL26189286 0.69 MAPT (0.40) MAPTL3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL10506532 0.69 MAPT (0.40) MAPTL3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL10512706 0.68 NMT1 (0.34) —
SCHEMBL18088629 0.68 SCN4A (0.40) MAPTL3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL10506536 0.68 MAPT (0.49) MAPTL3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL11687836 0.68 CRHR1 (0.42) MAPTL3MBTL1SMN1; SMN2KDM4ETDP1

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-0159584-B1 N-(AZOLYLCARBAMOYL)-HYDROXYL AMINES AND FUNGICIDES CONTAINING THEM BASF Aktiengesellschaft (DE) 1989-01-18 — — EP claimed
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