SCHEMBL3763145

SCHEMBL3763145

C=C(C)C(=O)OCCOC(=O)CCC(=O)OC1C(=O)OCC1(C)C

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CTSV O60911 1/20 0.32
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
TSHR P16473 2/20 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
SCHEMBL14341636 0.95 ALDH1A1 (0.34) THRBALDH1A1CTSVCTSLCTSS
SCHEMBL1697098 0.93 ALDH1A1 (0.35) THRBALDH1A1CTSVCTSLCTSS
SCHEMBL12651228 0.85 CTSV (0.33) ALDH1A1CTSVCTSLCTSSCTSK
SCHEMBL685109 0.85 ALDH1A1 (0.37) ALDH1A1CTSVCTSLCTSSCTSK
SCHEMBL305299 0.80 CTSV (0.36) ALDH1A1CTSVCTSLCTSSCTSK
SCHEMBL12783113 0.80 CTSV (0.37) CTSVCTSLCTSSCTSK
SCHEMBL14509255 0.77 MAPK1 (0.44) THRBALDH1A1TSHR
SCHEMBL12783089 0.77 CTSV (0.38) CTSVCTSLCTSSCTSK
SCHEMBL1697108 0.76 CTSV (0.35) ALDH1A1CTSVCTSLCTSSCTSK
SCHEMBL9883029 0.75 THRB (0.46) THRBALDH1A1CA1CA2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100316954-A1 MONOMER HAVING LACTONE SKELETON, POLYMER COMPOUND AND PHOTORESIST COMPOSITION DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-12-16 US disclosed
US-20100316954-A1 MONOMER HAVING LACTONE SKELETON, POLYMER COMPOUND AND PHOTORESIST COMPOSITION DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-12-16 US disclosed
US-20100316954-A1 MONOMER HAVING LACTONE SKELETON, POLYMER COMPOUND AND PHOTORESIST COMPOSITION DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-12-16 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-20100316954-A1 MONOMER HAVING LACTONE SKELETON, POLYMER COMPOUND AND PHOTORESIST COMPOSITION RRS1, CNKSR1, LSS THRB 3911/4885ALDH1A1 1413/4885CTSV 3037/4885

“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.