SCHEMBL5961812

SCHEMBL5961812

C=CC(=O)OCOc1ccc(OCOc2ccc3c(c2)Cc2cc(OC(=O)c4ccc(OCOC(=O)C=C)cc4)ccc2-3)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MAPT P10636 5/20 0.34
HIF1A Q16665 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
MCHR1 Q99705 3/20 0.34
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
HSD17B10 Q99714 1/20 0.33
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
BCL2L1 Q07817 1/20 0.32
MCL1 Q07820 1/20 0.32
GRM5 P41594 1/20 0.32

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
SCHEMBL14088491 0.98 THRB (0.37) THRBMAOAMAOBMAPTHIF1A
SCHEMBL12404385 0.90 MAOA (0.38) MAOAMAOBMAPTHIF1ANPC1
SCHEMBL13380196 0.86 THRB (0.44) THRBMAPTNPC1MCHR1KMT2A
SCHEMBL12510604 0.86 THRB (0.44) THRBMAOAMAOBMAPTNPC1
SCHEMBL12404294 0.86 MAOA (0.36) THRBMAOAMAOBMAPTHIF1A
SCHEMBL10308958 0.86 KMT2A (0.46) THRBMAOAMAPTKMT2AMEN1
SCHEMBL6536473 0.85 HTT (0.44) THRBMAPTNPC1MCHR1KMT2A
SCHEMBL13664616 0.84 HIF1A (0.35) THRBMAPTHIF1AKMT2AMEN1
SCHEMBL12242722 0.84 KMT2A (0.47) THRBMAOAMAPTKMT2AMEN1
SCHEMBL17734099 0.84 THRB (0.45) THRBMAPTNPC1KMT2AHSD17B10

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
US-8168734-B2 Lateral alpha-substituted acrylate compound and polymer thereof JNC CORPORATION (JP) 2012-05-01 US disclosed
US-20110144293-A1 LATERAL ALPHA-SUBSTITUTED ACRYLATE COMPOUND AND POLYMER THEREOF CHISSO CORPORATION (JP) 2011-06-16 US disclosed
US-7919648-B2 Lateral α-substituted acrylate compound and polymer thereof CHISSO CORPORATION (JP) 2011-04-05 US disclosed
US-20070134447-A1 Lateral a-substituted acrylate compound and polymer thereof CHISSO CORPORATION 2007-06-14 US disclosed
US-7157124-B2 Polymerizable compounds and their polymers CHISSO PETROCHEMICAL CORPORATION (JP) 2007-01-02 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 (2 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-20110144293-A1 LATERAL ALPHA-SUBSTITUTED ACRYLATE COMPOUND AND POLYMER THEREOF LEF1, AFF1, CNKSR1 THRB 1814/4885MAOA 3525/4885MAOB 3983/4885
US-20070134447-A1 Lateral a-substituted acrylate compound and polymer thereof AFF1, CNKSR1, LEF1 THRB 3134/4885MAOA 2647/4885MAOB 3400/4885

“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.