SCHEMBL4665795

SCHEMBL4665795

CCCCCCCCCCCCCCCCCCCCCCC1=NCCN1CCCCCCCCCCCCCCCCCCCCCC

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
GBA1 P04062 1/20 0.37
DRD4 P21917 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GNAI3 P08754 1/20 0.34
GNAO1 P09471 1/20 0.34
GNAI1 P63096 1/20 0.34
EEF2K O00418 1/20 0.33
SPHK1 Q9NYA1 2/20 0.33
ALOX5 P09917 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
SCHEMBL11138036 1.00 MEN1 (0.39) MEN1KMT2ACYP1A2CYP2D6GBA1
SCHEMBL28300124 1.00 MEN1 (0.39) MEN1KMT2ACYP1A2CYP2D6GBA1
SCHEMBL9787947 1.00 MEN1 (0.39) MEN1KMT2ACYP1A2CYP2D6GBA1
SCHEMBL5613182 0.98 CYP1A2 (0.39) MEN1KMT2ACYP1A2CYP2D6GBA1
Ethylene SCHEMBL27432416 0.97 MEN1 (0.38) MEN1KMT2ACYP1A2CYP2D6GBA1
SCHEMBL21195144 0.93 CYP1A2 (0.38) MEN1KMT2ACYP1A2CYP2D6DRD4
SCHEMBL9787907 0.93 CYP1A2 (0.38) MEN1KMT2ACYP1A2CYP2D6DRD4
SCHEMBL9787986 0.92 LMNA (0.39) MEN1KMT2ACYP1A2CYP2D6GBA1
SCHEMBL7602761 0.92 LMNA (0.39) MEN1KMT2ACYP1A2CYP2D6GBA1
SCHEMBL10005979 0.91 MGLL (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8409554-B2 Aqueous mixture of a mono C14-C22 trimethylammonium cationic surfactant, a di-(C20-C24) imidazoline quaternary surfactant, and a mono C12-C22 alkyl hydroxyethyl dimethylammonium surfactant; hair conditioners; smoothness, softness, manageability, cuticle integrity, antistatic agents and shine CONOPCO, INC. (US) 2013-04-02 US disclosed
US-20080233070-A1 Hair Treatment Compositions CONOPCO, INC. D/B/A UNILEVER 2008-09-25 US disclosed
EP-1725212-B1 HAIR TREATMENT COMPOSITIONS UNILEVER PLC (GB) 2007-06-27 EP disclosed
EP-1725212-A1 HAIR TREATMENT COMPOSITIONS UNILEVER PLC (GB) 2006-11-29 EP disclosed
WO-2005089702-A1 HAIR TREATMENT COMPOSITIONS UNILEVER PLC (GB) 2005-09-29 WO disclosed