SCHEMBL4195863

SCHEMBL4195863

CC(S)C(C)NC(=O)NC(C)C(C)S

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.34
NAALAD2 Q9Y3Q0 2/20 0.34
ALDH1A1 P00352 3/20 0.32
LMNA P02545 2/20 0.32
ACE P12821 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
MAPT P10636 1/20 0.31
PTGS2 P35354 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TAS1R3 Q7RTX0 2/20 0.30
TAS1R1 Q7RTX1 2/20 0.30
TAS1R2 Q8TE23 2/20 0.30
MME P08473 1/20 0.30
CPA1 P15085 1/20 0.30
ACE2 Q9BYF1 1/20 0.30

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
SCHEMBL13778719 0.80
SCHEMBL4993792 0.75 FOLH1 (0.37) FOLH1NAALAD2ALDH1A1LMNAACE
SCHEMBL2820334 0.75 TAS1R3 (0.46) FOLH1NAALAD2ALDH1A1LMNAMEN1
SCHEMBL20668082 0.69
SCHEMBL13951088 0.69 ALDH1A1 (0.45) FOLH1NAALAD2ALDH1A1LMNAMEN1
SCHEMBL745482 0.67 ALDH1A1 (0.54) FOLH1NAALAD2ALDH1A1LMNAMEN1
SCHEMBL6686267 0.65 ALDH1A1 (0.45) FOLH1NAALAD2ALDH1A1LMNAACE
SCHEMBL1870979 0.65 TP53 (0.39) FOLH1NAALAD2ALDH1A1LMNAMEN1
SCHEMBL21568355 0.63 TAS1R3 (0.42) ALDH1A1TAS1R3TAS1R1TAS1R2
SCHEMBL24408091 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1361246-B1 ORGANIC POLYMER AND NOVEL POLYMERIZABLE COMPOUND MITSUI CHEMICALS INC (JP) 2009-02-18 EP disclosed
US-6797805-B2 Organic polymers and novel polymerizable compounds MITSUI CHEMICALS, INC. (JP) 2004-09-28 US disclosed
EP-1361246-A1 ORGANIC POLYMER AND NOVEL POLYMERIZABLE COMPOUND Mitsui Chemicals, Inc. (JP) 2003-11-12 EP disclosed
US-20030166808-A1 Organic polymers and novel polymerizable compound MITSUI CHEMICALS, INC. (JP) 2003-09-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030166808-A1 Organic polymers and novel polymerizable compound PCNA, UTP18, ODC1 FOLH1 3523/4885NAALAD2 2943/4885ALDH1A1 4350/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.