SCHEMBL19316643

SCHEMBL19316643

C=C(C)C(=O)OCC(O)COC(=O)c1ccc(-c2ccc(C(=O)OC(CO)COC(=O)C(=C)C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.42
ADRB2 P07550 14/20 0.40
ADRB1 P08588 14/20 0.40
ADRB3 P13945 14/20 0.40
PRKCA P17252 1/20 0.40
SERPINE1 P05121 1/20 0.38
SLC1A5 Q15758 1/20 0.38
TSHR P16473 1/20 0.37

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
SCHEMBL19316662 0.96 PTPN1 (0.45) PTPN1ADRB2ADRB1ADRB3PRKCA
SCHEMBL19317038 0.93 PRKCA (0.45) PTPN1ADRB2ADRB1ADRB3PRKCA
SCHEMBL19316654 0.93 TSHR (0.42) PTPN1PRKCASERPINE1SLC1A5TSHR
SCHEMBL21422411 0.91 ADRB2 (0.41) PTPN1ADRB2ADRB1ADRB3PRKCA
SCHEMBL19316648 0.90 ADRB2 (0.36) PTPN1ADRB2ADRB1ADRB3PRKCA
SCHEMBL19316659 0.90 THRB (0.37) PTPN1ADRB2ADRB1ADRB3PRKCA
SCHEMBL19316655 0.89 ADRB2 (0.47) ADRB2ADRB1ADRB3SLC1A5TSHR
SCHEMBL21422384 0.86 PTPN1 (0.48) PTPN1SERPINE1SLC1A5TSHR
SCHEMBL19316657 0.85 PTPN1 (0.43) PTPN1PRKCASERPINE1TSHR
SCHEMBL21868937 0.85 TSHR (0.36) PTPN1PRKCASERPINE1SLC1A5TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170253555-A1 POLYMERIZABLE MONOMER, METHOD OF PRODUCING POLYMERIZABLE MONOMER, CURABLE COMPOSITION AND RESIN MEMBER TOKUYAMA DENTAL CORPORATION (JP) 2017-09-07 US disclosed
US-20170253555-A1 POLYMERIZABLE MONOMER, METHOD OF PRODUCING POLYMERIZABLE MONOMER, CURABLE COMPOSITION AND RESIN MEMBER TOKUYAMA DENTAL CORPORATION (JP) 2017-09-07 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-20170253555-A1 POLYMERIZABLE MONOMER, METHOD OF PRODUCING POLYMERIZABLE MONOMER, CURABLE COMPOSITION AND RESIN MEMBER H1-0, VMP1, CHRM1 PTPN1 4799/4885ADRB2 735/4885ADRB1 850/4885

“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.