SCHEMBL10062055

SCHEMBL10062055

Oc1cccc(C2CO2)c1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 6/20 0.59
DRD2 P14416 3/20 0.59
PARP1 P09874 1/20 0.55
TSHR P16473 1/20 0.54
CYP19A1 P11511 2/20 0.50
HTR2A P28223 1/20 0.49
HTR2C P28335 1/20 0.49
HTR2B P41595 1/20 0.49
CA12 O43570 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CA2 P00918 1/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
CA5A P35218 1/20 0.46
CA9 Q16790 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
DRD1 P21728 1/20 0.43

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
Phenol SCHEMBL2204930 0.94 TSHR (0.59) DRD3DRD2PARP1TSHRCYP19A1
SCHEMBL1556706 0.87 DRD3 (0.51) DRD3DRD2PARP1TSHRCYP19A1
SCHEMBL1555687 0.85 DRD3 (0.58) DRD3DRD2PARP1TSHRCYP19A1
SCHEMBL46283 0.84 TSHR (0.67) DRD3DRD2PARP1TSHRALDH1A1
SCHEMBL21974861 0.84 TSHR (0.67) DRD3DRD2PARP1TSHRALDH1A1
SCHEMBL18706863 0.79 DRD3 (0.59) DRD3DRD2CYP19A1ALDH1A1DRD1
Phenol SCHEMBL28650467 0.77 PARP1 (0.62) DRD3DRD2PARP1TSHRCA12
SCHEMBL22325842 0.77 DRD2 (0.46) DRD3DRD2HTR2AHTR2CHTR2B
SCHEMBL31125349 0.77 DRD3 (0.53) DRD3DRD2CYP19A1HTR2AHTR2C
SCHEMBL1135239 0.77 DRD3 (0.53) DRD3DRD2CYP19A1HTR2AHTR2C

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-8137700-B2 Main chain acid-degradable polymers for the delivery of bioactive materials U.S. DEPARTMENT OF ENERGY (US) 2012-03-20 US disclosed
US-20090220615-A1 Main Chain Acid-Degradable Polymers for the Delivery of Bioactive Materials THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2009-09-03 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-20090220615-A1 Main Chain Acid-Degradable Polymers for the Delivery of Bioactive Materials CTSA, GAA, CTSB DRD3 4809/4885DRD2 4799/4885PARP1 1067/4885

“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.