SCHEMBL5960259

SCHEMBL5960259

Cc1ccccc1OC(N)CN

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.49
SCN4A P35499 4/20 0.47
CYP1A2 P05177 4/20 0.42
TSHR P16473 4/20 0.42
CYP3A4 P08684 3/20 0.42
CYP2D6 P10635 3/20 0.42
SLC6A2 P23975 3/20 0.42
CHRM1 P11229 2/20 0.42
ADRA2B P18089 2/20 0.42
HTR2A P28223 2/20 0.42
HTR2C P28335 2/20 0.42
SLC6A4 P31645 2/20 0.42
HRH1 P35367 2/20 0.42
OPRM1 P35372 2/20 0.42
DRD3 P35462 2/20 0.42
OPRK1 P41145 2/20 0.42
HTR2B P41595 2/20 0.42
SLC6A3 Q01959 2/20 0.42
KCNH2 Q12809 2/20 0.42
KLF10 Q13118 2/20 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
SCHEMBL10552288 0.84 SCN4A (0.47) ALOX15SCN4ACYP1A2TSHRCYP3A4
SCHEMBL6318517 0.80 ALOX15 (0.49) ALOX15SCN4ACYP1A2TSHRCYP3A4
SCHEMBL27684350 0.79 SCN4A (0.48) ALOX15SCN4ACYP1A2TSHRCYP3A4
SCHEMBL6495128 0.77 SCN4A (0.47) ALOX15SCN4ACYP1A2TSHRCYP3A4
SCHEMBL22680716 0.74 ALOX15 (0.44) ALOX15SCN4ACYP1A2TSHRCYP3A4
SCHEMBL6693445 0.73 ALOX15 (0.46) ALOX15SCN4ACYP1A2TSHRCYP3A4
SCHEMBL28911420 0.73 TSHR (0.46) ALOX15SCN4ACYP1A2TSHRCYP3A4
SCHEMBL13696499 0.72 NISCH (0.49) ALOX15SCN4ACYP1A2TSHRCYP3A4
SCHEMBL11543855 0.72 SCN4A (0.43) ALOX15SCN4ACYP1A2TSHRCYP3A4
SCHEMBL6522054 0.72 ALDH1A1 (0.53) CYP1A2TSHRADRA2BKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1658128-A1 MULTI-CONSTITUENT PACKAGING COMPRISING A STATIC MICROMIXER Wella Aktiengesellschaft (DE) 2006-05-24 EP disclosed
WO-2005018785-A1 MULTI-CONSTITUENT PACKAGING COMPRISING A STATIC MICROMIXER WELLA AKTIENGESELLSCHAFT (DE) 2005-03-03 WO disclosed
EP-1189576-A2 HAIR COMPOSITION COMPRISING AN OXIDASE AND CYCLODEXTRIN Lion Corporation (JP) 2002-03-27 EP disclosed
EP-1187596-A2 HAIRDYE COMPOSITION COMPRISING INDOLINE AND/OR AN INDOLINE COMPOUND AND LACCASE Lion Corporation (JP) 2002-03-20 EP disclosed
EP-1165027-A1 HAIRDYE COMPOSITION OF SINGLE PREPARATION TYPE CONTAINING AN OXIDASE Lion Corporation (JP) 2002-01-02 EP disclosed
WO-2001000144-A2 HAIR COMPOSITION COMPRISING AN OXIDASE AND CYCLODEXTRIN LION CORPORATION (JP) 2001-01-04 WO disclosed
WO-2000078274-A2 HAIRDYE COMPOSITION COMPRISING INDOLINE AND/OR AN INDOLINE COMPOUND AND LACCASE LION CORPORATION (JP) 2000-12-28 WO disclosed
WO-2000059459-A1 HAIRDYE COMPOSITION OF SINGLE PREPARATION TYPE CONTAINING AN OXIDASE LION CORPORATION (JP) 2000-10-12 WO disclosed