SCHEMBL7030236

SCHEMBL7030236

Nc1ccc(NCC(O)O)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.41
RAB9A P51151 2/20 0.41
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
APP P05067 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HTT P42858 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX12 P18054 1/20 0.38
CYP2C19 P33261 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
APEX1 P27695 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
Sulfuric Acid SCHEMBL7030233 0.90 ALDH1A1 (0.41) MAPTRAB9AALDH1A1HTTCYP3A4
SCHEMBL5155005 0.88 MAPT (0.43) MAPTRAB9AMAOAMAOBAPP
SCHEMBL2028408 0.86 MAPT (0.44) MAPTRAB9AMAOAMAOBAPP
Hydrochloric Acid SCHEMBL5426909 0.86 MAPT (0.41) MAPTRAB9AMAOAMAOBAPP
SCHEMBL28407954 0.84 MAPT (0.40) MAPTRAB9AMAOAMAOBAPP
SCHEMBL33958 0.83 CA12 (0.40) MAPTRAB9AMAOAMAOBAPP
Hydrochloric Acid SCHEMBL11207559 0.81 CA12 (0.39) MAPTRAB9AMAOAMAOBAPP
SCHEMBL33651 0.81 MAPT (0.41) MAPTRAB9AMAOAMAOBAPP
Hydrochloric Acid SCHEMBL11207303 0.81 CA12 (0.39) MAPTRAB9AMAOAMAOBAPP
SCHEMBL4851308 0.81 MAPT (0.41) MAPTRAB9AMAOAMAOBAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111440077-B Synthesis method of 2, 5-diaminophenylethanol sulfate and application thereof in antiallergic hair dye 上海舒尔发化妆品科技有限公司 2022-07-22 CN disclosed
CN-111440077-A Synthesis method of 2, 5-diaminophenylethanol sulfate and application thereof in anti-allergic hair dye 上海舒尔发化妆品科技有限公司 2020-07-24 CN disclosed
CN-110742823-A Bubble hair dye prepared from cellulose extracted from straws and preparation method thereof 江苏新宇生物科技有限公司 2020-02-04 CN disclosed
CN-1205910-C Yellow hair coloring compositions with improved long wear characteristics P & P CLAROL INC (US) 2005-06-15 CN disclosed
CN-1462183-A Yellow hair coloring compositions with improved long wear characteristics P & G CLAROL INC (US) 2003-12-17 CN disclosed
US-20030135935-A1 Enhanced color deposition for hair with sequestering agents UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-07-24 US disclosed
EP-0430032-A1 Dye couplers Bristol-Myers Squibb Company (US) 1991-06-05 EP disclosed
US-4021486-A Hydroxyalkyl-amino nitrodiphenylamine compounds useful as hair dyes CLAIROL INCORPORATED (US) 1977-05-03 US disclosed
US-3950127-A HAIR DYE COMPOSITIONS CONTAINING NITRODIPHENYLAMINE DYES AND METHOD FOR DYEING HAIR THEREWITH CLAIROL INCORPORATED (US) 1976-04-13 US disclosed