SCHEMBL26627710

SCHEMBL26627710

Nc1cc2oc3cc(Br)ccc3c2cc1Br

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.38
▸ KDM4E B2RXH2 6/20 0.38
▸ ALDH1A1 P00352 5/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ HPGD P15428 2/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ GLA P06280 1/20 0.35
▸ PDPK1 O15530 2/20 0.34
▸ JAK2 O60674 2/20 0.34
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ TBK1 Q9UHD2 1/20 0.32
▸ ADORA2A P29274 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
SCHEMBL31190195 0.84 MAPT (0.41) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL29654967 0.82 MAPT (0.50) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL203439 0.82 MAPT (0.50) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL26631793 0.81 KMT2A (0.56) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL31615586 0.79 MAPT (0.60) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL30693959 0.78 PIM1 (0.48) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL3771900 0.78 PIM1 (0.48) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL24528458 0.74 MAPT (0.59) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL19561508 0.73 PIM1 (0.52) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL24725891 0.73 MAPT (0.41) MAPTKDM4EALDH1A1MEN1KMT2A

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-2023202502-A1 AZOLE-CONTAINING ORGANIC COMPOUND AND USE THEREOF 上海传勤新材料有限公司 2023-10-26 — — WO disclosed
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