SCHEMBL444542

SCHEMBL444542

CC(S)C(=O)O.CC(S)C(=O)O.CC(S)C(=O)O.CCC(CO)(CO)CO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RNPEP Q9H4A4 2/20 0.38
TDP1 Q9NUW8 3/20 0.36
CHRM1 P11229 1/20 0.36
AKR1A1 P14550 1/20 0.36
CHRM3 P20309 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
ADRA1A P35348 1/20 0.36
HRH1 P35367 1/20 0.36
DRD3 P35462 1/20 0.36
SLC6A3 Q01959 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
ACE P12821 2/20 0.35
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
PTGS2 P35354 1/20 0.34
GABRR1 P24046 2/20 0.33
CYP1A2 P05177 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
SCHEMBL17667485 1.00 RNPEP (0.38) RNPEPTDP1CHRM1AKR1A1CHRM3
SCHEMBL28215927 1.00 RNPEP (0.38) RNPEPTDP1CHRM1AKR1A1CHRM3
SCHEMBL15809468 1.00 RNPEP (0.38) RNPEPTDP1CHRM1AKR1A1CHRM3
SCHEMBL2768344 0.88 TDP1 (0.37) RNPEPTDP1CHRM1AKR1A1CHRM3
SCHEMBL467265 0.88 RNPEP (0.42) RNPEPTDP1CHRM1AKR1A1CHRM3
SCHEMBL29366714 0.88 RNPEP (0.42) RNPEPTDP1CHRM1AKR1A1CHRM3
SCHEMBL4967302 0.88 RNPEP (0.42) RNPEPTDP1CHRM1AKR1A1CHRM3
SCHEMBL16536080 0.88 RNPEP (0.42) RNPEPTDP1CHRM1AKR1A1CHRM3
SCHEMBL1171013 0.88 RNPEP (0.42) RNPEPTDP1CHRM1AKR1A1CHRM3
Mercaptopropionic Acid SCHEMBL7039972 0.87 FOLH1 (0.39) TDP1ACEALDH1A1MAPTLMNA

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 570 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4601858-A1 METHOD FOR THREE-DIMENSIONAL PRINTING OF FIBER COMPOSITE MATERIALS MOI COMPOSITES S.r.l. (IT) 2025-08-20 EP claimed
CN-120018945-A Three-dimensional printing method for fiber composite material MOI复合材料有限责任公司 2025-05-16 CN claimed
CN-119899380-A Acrylic ester matrix for low-odor rock plate adhesive, rock plate adhesive and preparation method of acrylic ester matrix 江苏大力士云石护理材料有限公司 2025-04-29 CN claimed
US-20250101202-A1 ISOCYANATE COMPOSITION AND OPTICAL COMPOSITION Hanwha Solutions Corporation (KR) 2025-03-27 US claimed
CN-119329160-A Thermochromic film based on liquid crystal and preparation method thereof 纳琳科新材料(南通)有限公司 2025-01-21 CN claimed
EP-4442725-A1 ISOCYANATE COMPOSITION AND OPTICAL COMPOSITION Hanwha Solutions Corporation (KR) 2024-10-09 EP claimed
CN-118317991-A Isocyanate composition and optical composition 韩华思路信(株) 2024-07-09 CN claimed
CN-115443296-B Diisocyanate composition and optical lens produced using the same 爱思开核心聚氨酯有限公司 2024-05-07 CN claimed
WO-2024079597-A1 METHOD FOR THREE-DIMENSIONAL PRINTING OF FIBER COMPOSITE MATERIALS MOI COMPOSITES S.R.L. (IT) 2024-04-18 WO claimed
WO-2024048993-A1 ISOCYANATE COMPOSITION 한화솔루션 주식회사 2024-03-07 WO claimed
EP-0802431-B1 Process for the production of polyurethane lens HOYA CORP (JP) 2002-01-16 EP claimed
US-5744568-A REACTING POLYISOCYANATE AND POLYTHIOL COMPOUND HOYA CORPORATION (JP) 1998-04-28 US claimed
EP-0645647-B1 Process for the reproduction of polyurethane lens HOYA CORP (JP) 1998-01-14 EP claimed
EP-0803743-A2 Process for the production of polyurethane lens HOYA CORPORATION (JP) 1997-10-29 EP claimed
EP-0803744-A2 Transparent polyurethane lens free of optical strain and striae HOYA CORPORATION (JP) 1997-10-29 EP claimed
EP-0802431-A2 Process for the production of polyurethane lens HOYA CORPORATION (JP) 1997-10-22 EP claimed
US-5635580-A REACTING A POLYISOCYANATE COMPOUND AND TWO OR MORE POLYTHIOL COMPOUNDS WHICH HAVE DIFFERENT REACTION RATES WITH THE POLYISOCYANATE COMPOUND IN THE PRESENCE OF AN ALKYLTIN HALIDE HOYA CORPORATION (JP) 1997-06-03 US claimed
WO-1996040528-A1 THIOL-CONTAINING PHOTOSENSITIVE POLYMERIC FOAM COMPOSITIONS PT SUB, INC. (US) 1996-12-19 WO claimed
EP-0645647-A1 Process for the reproduction of polyurethane lens HOYA CORPORATION (JP) 1995-03-29 EP claimed
US-4775733-A POLYTHIOURETHANES MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1988-10-04 US claimed