SCHEMBL7599207

SCHEMBL7599207

Cc1[nH]c(C)c(C2=CC(=O)c3ccccc3C2=O)c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 4/20 0.47
▸ MAPT P10636 3/20 0.43
▸ HTT P42858 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ APAF1 O14727 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ CDC25B P30305 5/20 0.42
▸ LMNA P02545 4/20 0.42
▸ CDC25A P30304 4/20 0.42
▸ BLM P54132 2/20 0.42
▸ ATM Q13315 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ GAA P10253 2/20 0.42
▸ IDO1 P14902 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ PLIN1 O60240 1/20 0.42
▸ NR1I2 O75469 1/20 0.42
▸ USP2 O75604 1/20 0.42

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
SCHEMBL7596956 0.85 LMNA (0.59) BACE1MAPTHTTALDH1A1KMT2A
SCHEMBL7808779 0.82 S100A4 (0.44) MAPTALDH1A1KMT2ACDC25BSMN1; SMN2
SCHEMBL9562286 0.75 CCR6 (0.62) BACE1MAPTHTTALDH1A1KMT2A
SCHEMBL21808995 0.75 MAPT (0.55) MAPTHTTALDH1A1KMT2ARAB9A
SCHEMBL7598512 0.74 SMN1; SMN2 (0.55) BACE1MAPTHTTALDH1A1KMT2A
SCHEMBL4190274 0.74 LMNA (0.68) MAPTHTTALDH1A1KMT2ARAB9A
SCHEMBL7597626 0.72 RAB9A (0.49) MAPTHTTALDH1A1KMT2ARAB9A
SCHEMBL7772483 0.72 LMNA (0.70) MAPTHTTALDH1A1KMT2ARAB9A
SCHEMBL8047777 0.72 BACE1 (0.50) BACE1MAPTHTTALDH1A1KMT2A
SCHEMBL7608536 0.71 LMNA (0.51) BACE1MAPTHTTALDH1A1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0861830-B1 Use of 1,4-naphthoquinone and 1,4-dihydroxynaphthalene pyrrole derivatives for dyeing keratinous material, compounds and compositions containing them OREAL (FR) 2002-12-18 — — EP claimed
US-6022379-A HAIR DYE L'OREAL (FR) 2000-02-08 — — US claimed
US-6022379-A HAIR DYE L'OREAL (FR) 2000-02-08 — — US disclosed
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