SCHEMBL2886892

SCHEMBL2886892

CCc1cc(C2CCCCC2)c(C)c(OC(=O)c2ccccc2)c1OC(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.40
LMNA P02545 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 1/20 0.39
SCN1A P35498 1/20 0.39
SCN2A Q99250 1/20 0.39
SCN3A Q9NY46 1/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 2/20 0.38
KMO O15229 1/20 0.37
SLC6A9 P48067 1/20 0.37
MEN1 O00255 1/20 0.36
ATM Q13315 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
STAT3 P40763 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL2477415 0.99 LMNA (0.39) PTGDR2LMNACYP1A2CYP2D6SCN1A
SCHEMBL2499852 0.92 PPARG (0.38) PTGDR2LMNACYP1A2CYP2D6SCN1A
SCHEMBL2506623 0.91 PPARG (0.38) PTGDR2LMNACYP1A2CYP2D6SCN1A
SCHEMBL2510238 0.88 PTGDR2 (0.40) PTGDR2LMNACYP1A2CYP2D6SCN1A
SCHEMBL2505747 0.88 PTGDR2 (0.40) PTGDR2LMNACYP1A2CYP2D6SCN1A
SCHEMBL2499540 0.88 PTGDR2 (0.40) PTGDR2LMNACYP1A2CYP2D6SCN1A
SCHEMBL2502609 0.88 PTGDR2 (0.40) PTGDR2LMNACYP1A2CYP2D6SCN1A
SCHEMBL2508648 0.87 LMNA (0.39) PTGDR2LMNACYP1A2CYP2D6SCN1A
SCHEMBL2504969 0.87 LMNA (0.39) PTGDR2LMNACYP1A2CYP2D6SCN1A
SCHEMBL25429111 0.86 KMO (0.40) PTGDR2LMNACYP1A2CYP2D6SCN1A

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-8604235-B2 Production of substituted phenylene aromatic diesters and compositions DOW GLOBAL TECHNOLOGIES LLC (US) 2013-12-10 US disclosed
US-20100204506-A1 Production of Substituted Phenylene Aromatic Diesters and Compositions W. R. GRACE & CO.-CONN. 2010-08-12 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-20100204506-A1 Production of Substituted Phenylene Aromatic Diesters and Compositions PAH, DDC, DDT PTGDR2 1971/4885LMNA 4145/4885CYP1A2 76/4885

“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.