SCHEMBL26136168

SCHEMBL26136168

CCCCCCCCOCCCCCCCCCCOCC(O)CNCCN

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.63
USP2 O75604 1/20 0.56
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C19 P33261 1/20 0.48
LPAR5 Q9H1C0 1/20 0.48
TLR2 O60603 6/20 0.47
KDM4E B2RXH2 1/20 0.44
SPHK1 Q9NYA1 1/20 0.43
PLA2G2C Q5R387 2/20 0.41
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.41
CASR P41180 1/20 0.40
PLA2G2D Q9UNK4 1/20 0.39

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
SCHEMBL26135978 1.00 HTT (0.63) HTTUSP2CYP1A2CYP3A4CYP2C19
SCHEMBL11231700 0.98 HTT (0.65) HTTUSP2CYP1A2CYP3A4CYP2C19
SCHEMBL11236320 0.98 HTT (0.65) HTTUSP2CYP1A2CYP3A4CYP2C19
SCHEMBL11223752 0.98 HTT (0.65) HTTUSP2CYP1A2CYP3A4CYP2C19
SCHEMBL11239030 0.98 HTT (0.65) HTTUSP2CYP1A2CYP3A4CYP2C19
SCHEMBL11230752 0.98 HTT (0.65) HTTUSP2CYP1A2CYP3A4CYP2C19
SCHEMBL11238943 0.98 HTT (0.65) HTTUSP2CYP1A2CYP3A4CYP2C19
SCHEMBL11023778 0.97 HTT (0.62) HTTUSP2CYP1A2CYP3A4CYP2C19
SCHEMBL4791926 0.93 HTT (0.58) HTTUSP2CYP1A2CYP3A4CYP2C19
SCHEMBL11232438 0.92 HTT (0.54) HTTUSP2CYP1A2CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023180027-A1 NOVEL CATIONIC COLLECTORS FOR IMPROVING A PROCESS FOR FROTH FLOTATION OF SILICATES CLARIANT INTERNATIONAL LTD (CH) 2023-09-28 WO claimed
WO-2023180027-A1 NOVEL CATIONIC COLLECTORS FOR IMPROVING A PROCESS FOR FROTH FLOTATION OF SILICATES CLARIANT INTERNATIONAL LTD (CH) 2023-09-28 WO disclosed