SCHEMBL6941272

SCHEMBL6941272

Cc1cc(O)c(NC(=O)Cn2cc[n+](C)c2)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.44
LMNA P02545 4/20 0.44
MAPK1 P28482 3/20 0.44
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.43
HTT P42858 1/20 0.43
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
POLB P06746 1/20 0.35

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
Hydrochloric Acid SCHEMBL6940892 0.99 HPGD (0.43) HPGDLMNAMAPK1ALDH1A1TSHR
SCHEMBL6937070 0.87 HPGD (0.41) HPGDLMNAMAPK1ALDH1A1TSHR
SCHEMBL6946185 0.86 LMNA (0.40) HPGDLMNAMAPK1ALDH1A1TSHR
SCHEMBL6572100 0.86 HPGD (0.43) HPGDLMNAMAPK1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL6938864 0.86 LMNA (0.40) HPGDLMNAMAPK1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL6572664 0.85 HPGD (0.42) HPGDLMNAMAPK1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL6939645 0.85 LMNA (0.39) HPGDLMNAMAPK1ALDH1A1TSHR
SCHEMBL6943533 0.84 LMNA (0.39) HPGDLMNAMAPK1ALDH1A1TSHR
SCHEMBL6939908 0.84 LMNA (0.39) HPGDLMNAMAPK1ALDH1A1TSHR
SCHEMBL6939897 0.83 ALDH1A1 (0.43) HPGDLMNAMAPK1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066022-B1 COMPOSITIONS FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC COUPLER, NOVEL CATIONIC COUPLERS, THEIR USE FOR OXIDATION DYEING AND DYEING METHODS OREAL (FR) 2003-10-22 EP claimed
EP-1066022-A1 COMPOSITIONS FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC COUPLER, NOVEL CATIONIC COUPLERS, THEIR USE FOR OXIDATION DYEING AND DYEING METHODS L'OREAL (FR) 2001-01-10 EP claimed
WO-2000042979-A1 COMPOSITIONS FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC COUPLER, NOVEL CATIONIC COUPLERS, THEIR USE FOR OXIDATION DYEING AND DYEING METHODS L'OREAL (FR) 2000-07-27 WO claimed
EP-1066022-B1 COMPOSITIONS FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC COUPLER, NOVEL CATIONIC COUPLERS, THEIR USE FOR OXIDATION DYEING AND DYEING METHODS OREAL (FR) 2003-10-22 EP disclosed
EP-1066022-A1 COMPOSITIONS FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC COUPLER, NOVEL CATIONIC COUPLERS, THEIR USE FOR OXIDATION DYEING AND DYEING METHODS L'OREAL (FR) 2001-01-10 EP disclosed
WO-2000042979-A1 COMPOSITIONS FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC COUPLER, NOVEL CATIONIC COUPLERS, THEIR USE FOR OXIDATION DYEING AND DYEING METHODS L'OREAL (FR) 2000-07-27 WO disclosed