SCHEMBL31190195

SCHEMBL31190195

Brc1ccc2c(c1)oc1cc(Br)c(Br)cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ ALOX15 P16050 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ AHR P35869 5/20 0.39
▸ CYP11B1 P15538 1/20 0.36
▸ CYP11B2 P19099 1/20 0.36
▸ PIM1 P11309 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ GRM4 Q14833 1/20 0.33
▸ MAPK1 P28482 2/20 0.32
▸ CYP2A6 P11509 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HSP90AA1 P07900 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
SCHEMBL29654967 0.89 MAPT (0.50) MAPTALDH1A1KDM4EALOX15LMNA
SCHEMBL203439 0.89 MAPT (0.50) MAPTALDH1A1KDM4EALOX15LMNA
SCHEMBL3771900 0.84 PIM1 (0.48) MAPTALDH1A1KDM4EALOX15LMNA
SCHEMBL30693959 0.84 PIM1 (0.48) MAPTALDH1A1KDM4EALOX15LMNA
SCHEMBL26627710 0.84 MAPT (0.38) MAPTALDH1A1KDM4EALOX15LMNA
SCHEMBL19561508 0.79 PIM1 (0.52) MAPTALDH1A1KDM4EALOX15LMNA
SCHEMBL29381559 0.78 AHR (0.59) MAPTALDH1A1KDM4ESMN1; SMN2HSD17B10
SCHEMBL25611877 0.78 AHR (0.59) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL259160 0.78 AHR (0.59) MAPTALDH1A1KDM4ESMN1; SMN2HSD17B10
SCHEMBL10122754 0.78 CYP2A6 (0.48) MAPTALDH1A1KDM4EALOX15LMNA

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
CN-118852191-A Compound taking fluoranthene double five-membered ring as parent nucleus and application thereof 西安瑞联新材料股份有限公司 2024-10-29 — — CN disclosed
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