SCHEMBL6667522

SCHEMBL6667522

CC(c1ncccc1O)N(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MMP2 P08253 1/20 0.38
CHRM1 P11229 1/20 0.38
TSHR P16473 1/20 0.38
COMT P21964 1/20 0.38
ADRA1A P35348 1/20 0.38
METAP2 P50579 1/20 0.38
METAP1 P53582 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
IDO1 P14902 1/20 0.36
KDM4E B2RXH2 6/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 2/20 0.34
SLC6A2 P23975 1/20 0.34
KMT2A Q03164 2/20 0.34
ALOX12 P18054 1/20 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
SCHEMBL31155959 0.81 GABRA1 (0.50) HSD17B10ALDH1A1L3MBTL1MMP2CHRM1
SCHEMBL364693 0.81 GABRA1 (0.50) HSD17B10ALDH1A1L3MBTL1MMP2CHRM1
SCHEMBL24569220 0.80 ALDH1A1 (0.39) HSD17B10ALDH1A1L3MBTL1MMP2CHRM1
Methane SCHEMBL10700573 0.79 GABRA1 (0.48) HSD17B10ALDH1A1L3MBTL1MMP2CHRM1
SCHEMBL30853079 0.78 ALDH1A1 (0.42) HSD17B10ALDH1A1L3MBTL1MMP2CHRM1
SCHEMBL18361548 0.76 ALDH1A1 (0.41) HSD17B10ALDH1A1L3MBTL1MMP2CHRM1
SCHEMBL27763192 0.76 ALDH1A1 (0.41) HSD17B10ALDH1A1L3MBTL1MMP2CHRM1
SCHEMBL1333769 0.73 ALDH1A1 (0.38) HSD17B10ALDH1A1L3MBTL1MMP2CHRM1
SCHEMBL9627663 0.73 ALDH1A1 (0.45) HSD17B10ALDH1A1L3MBTL1MMP2CHRM1
SCHEMBL5801755 0.72 ALDH1A1 (0.37) HSD17B10ALDH1A1L3MBTL1MMP2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118043022-A Composition comprising a dye and an inorganic alkalizing agent 花王株式会社 2024-05-14 CN claimed
EP-1250912-B1 Hair dye composition KPSS KAO GMBH (DE) 2004-09-15 EP claimed
EP-1297818-A2 Hair dye KPSS-Kao Professional Salon Services GmbH (DE) 2003-04-02 EP claimed
EP-1250912-A1 Hair dye composition GOLDWELL GmbH (DE) 2002-10-23 EP claimed
CN-118804737-A Dyeing composition in aqueous alcohol medium 花王株式会社 2024-10-18 CN disclosed
CN-118043022-A Composition comprising a dye and an inorganic alkalizing agent 花王株式会社 2024-05-14 CN disclosed
CN-114615967-A Two-component oxidation dyeing composition 花王株式会社 2022-06-10 CN disclosed
EP-1250912-B1 Hair dye composition KPSS KAO GMBH (DE) 2004-09-15 EP disclosed
EP-1297818-A2 Hair dye KPSS-Kao Professional Salon Services GmbH (DE) 2003-04-02 EP disclosed
EP-1250912-A1 Hair dye composition GOLDWELL GmbH (DE) 2002-10-23 EP disclosed