SCHEMBL3154151

SCHEMBL3154151

CCCCCCCCCCCCCCCCCCOC(=O)CCC(C)=O

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.66
NAAA Q02083 1/20 0.64
DGKA P23743 1/20 0.64
RAD52 P43351 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
PRSS1 P07477 1/20 0.54
PRSS2 P07478 1/20 0.54
PRSS3 P35030 1/20 0.54
TSHR P16473 2/20 0.53
FAAH O00519 1/20 0.53
DNM1 Q05193 1/20 0.53
CES2 O00748 1/20 0.52
EPHX1 P07099 1/20 0.50
PAM P19021 2/20 0.48
ALDH1A1 P00352 1/20 0.48

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
SCHEMBL12075380 1.00 HTR2C (0.66) HTR2CNAAADGKARAD52NPSR1
SCHEMBL3714353 1.00 HTR2C (0.66) HTR2CNAAADGKARAD52NPSR1
SCHEMBL3714189 1.00 HTR2C (0.66) HTR2CNAAADGKARAD52NPSR1
SCHEMBL3713746 1.00 HTR2C (0.66) HTR2CNAAADGKARAD52NPSR1
SCHEMBL1685026 1.00 HTR2C (0.66) HTR2CNAAADGKARAD52NPSR1
SCHEMBL16837098 1.00 HTR2C (0.66) HTR2CNAAADGKARAD52NPSR1
SCHEMBL11214363 1.00 HTR2C (0.66) HTR2CNAAADGKARAD52NPSR1
SCHEMBL875181 0.98 HTR2C (0.62) HTR2CNAAADGKARAD52NPSR1
SCHEMBL118152 0.92 ALDH1A1 (0.58) HTR2CNAAADGKARAD52NPSR1
SCHEMBL18995 0.92 NAAA (0.75) HTR2CNAAADGKARAD52NPSR1

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
CN-113767097-B Prodrugs of caspase inhibitors 株式会社LG化学 2025-03-14 CN disclosed
EP-1498447-B1 Photochromic material PILOT INK CO LTD (JP) 2010-02-24 EP disclosed
US-7351362-B2 Photochromic material THE PILOT INK CO., LTD. (JP) 2008-04-01 US disclosed
US-20050012081-A1 Photochromic material THE PILOT INK CO., LTD. 2005-01-20 US disclosed
EP-1498447-A1 Photochromic material THE PILOT INK CO., LTD. (JP) 2005-01-19 EP disclosed