SCHEMBL19216112

SCHEMBL19216112

CCCCc1cc(Cl)cc(C=O)c1O

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 8/20 0.56
EGFR P00533 1/20 0.39
TYR P14679 1/20 0.38
PIM1 P11309 1/20 0.37
MAOA P21397 1/20 0.36
ALOX5 P09917 4/20 0.36
PTGS2 P35354 3/20 0.36
CNR2 P34972 1/20 0.35
CTRC Q99895 1/20 0.35

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
SCHEMBL5883536 0.84 ERN1 (0.67) ERN1PIM1
SCHEMBL13190731 0.83 ALOX5 (0.49) ERN1EGFRTYRALOX5PTGS2
SCHEMBL3967922 0.82 NPC1 (0.44) ERN1EGFRTYRALOX5PTGS2
SCHEMBL22763890 0.81 ERN1 (0.51) ERN1EGFRTYRALOX5PTGS2
SCHEMBL22764010 0.78 ERN1 (0.45) ERN1TYRALOX5PTGS2
SCHEMBL15151739 0.78 CYP2C19 (0.39) ERN1EGFRTYRMAOAALOX5
SCHEMBL8393034 0.78 TYR (0.43) EGFRTYRMAOAALOX5PTGS2
SCHEMBL5021200 0.78 ERN1 (0.67) ERN1PIM1
SCHEMBL5673519 0.76 PTGS2 (0.50) EGFRALOX5PTGS2
SCHEMBL38662732 0.75 PTGS2 (0.53) EGFRTYRALOX5PTGS2

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-10377850-B2 Polyester stereocomplexes, compositions comprising same, and methods of making and using same CORNELL UNIVERSITY (US) 2019-08-13 US disclosed
US-20170226283-A1 POLYESTER STEREOCOMPLEXES, COMPOSITIONS COMPRISING SAME, AND METHODS OF MAKING AND USING SAME NATIONAL SCIENCE FOUNDATION 2017-08-10 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-10377850-B2 Polyester stereocomplexes, compositions comprising same, and methods of making and using same EPHX2, GNE, EPHX1 ERN1 2302/4885EGFR 1242/4885TYR 4878/4885

“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.