SCHEMBL3962932

SCHEMBL3962932

C[CH]COCCCCCCCCCCCCCCCCCC

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.48
THRB P10828 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 1/20 0.48
CES2 O00748 2/20 0.45
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
USP2 O75604 1/20 0.42
CES1 P23141 1/20 0.41
TSHR P16473 2/20 0.40
LSS P48449 1/20 0.40
SPHK1 Q9NYA1 1/20 0.37

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
SCHEMBL6934589 1.00 HTT (0.48) HTTTHRBMEN1KMT2AMAPT
SCHEMBL6936178 1.00 HTT (0.48) HTTTHRBMEN1KMT2AMAPT
SCHEMBL6939366 1.00 HTT (0.48) HTTTHRBMEN1KMT2AMAPT
SCHEMBL6938921 1.00 HTT (0.48) HTTTHRBMEN1KMT2AMAPT
SCHEMBL6939702 1.00 HTT (0.48) HTTTHRBMEN1KMT2AMAPT
SCHEMBL1609595 1.00 HTT (0.48) HTTTHRBMEN1KMT2AMAPT
SCHEMBL2764674 1.00 HTT (0.48) HTTTHRBMEN1KMT2AMAPT
SCHEMBL4302940 1.00 HTT (0.48) HTTTHRBMEN1KMT2AMAPT
SCHEMBL6936434 1.00 HTT (0.48) HTTTHRBMEN1KMT2AMAPT
SCHEMBL2902805 0.97

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
WO-2009129385-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO claimed
WO-2009129387-A2 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO claimed
WO-2019188936-A1 HYDROGEL 積水化成品工業株式会社 2019-10-03 WO disclosed
CN-103966902-B Moistening paper power reinforcing agent and the interior paper adding this moistening paper power reinforcing agent 星光PMC株式会社 2016-08-10 CN disclosed
WO-2009129387-A2 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed
WO-2009129395-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed
EP-0147446-A4 IMPROVED COMPOSITIONS FOR THE TREATMENT OF PSORIASIS. STIEFEL LABORATORIES (US) 1987-04-29 EP disclosed
EP-0147446-A1 IMPROVED COMPOSITIONS FOR THE TREATMENT OF PSORIASIS STIEFEL LABORATORIES, INC. (US) 1985-07-10 EP disclosed
WO-1985000106-A1 IMPROVED COMPOSITIONS FOR THE TREATMENT OF PSORIASIS STIEFEL LABORATORIES, INC. (US) 1985-01-17 WO disclosed