SCHEMBL2886766

SCHEMBL2886766

Cc1ccc(C2CCCCC2)c(OC(=O)c2ccccc2)c1OC(=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.41
PTGDR2 Q9Y5Y4 2/20 0.41
CYP1A2 P05177 2/20 0.40
LMNA P02545 1/20 0.40
CYP2D6 P10635 1/20 0.40
SCN1A P35498 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 1/20 0.40
KMT2A Q03164 7/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
STAT3 P40763 1/20 0.40
MEN1 O00255 3/20 0.39
MAPT P10636 1/20 0.39
POLB P06746 1/20 0.38
ELANE P08246 1/20 0.38
ATM Q13315 1/20 0.37
APOBEC3A P31941 1/20 0.37
APOBEC3G Q9HC16 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
SCHEMBL2479754 0.99 KMT2A (0.40) KMOPTGDR2CYP1A2LMNACYP2D6
SCHEMBL2509192 0.92 KMO (0.47) KMOPTGDR2CYP1A2LMNACYP2D6
SCHEMBL2508681 0.92 KMO (0.47) KMOPTGDR2CYP1A2LMNACYP2D6
SCHEMBL2503619 0.90 KMT2A (0.46) KMOPTGDR2CYP1A2LMNACYP2D6
SCHEMBL25429111 0.84 KMO (0.40) KMOPTGDR2CYP1A2LMNACYP2D6
SCHEMBL30035926 0.84 KMO (0.40) KMOPTGDR2CYP1A2LMNACYP2D6
SCHEMBL27182061 0.84 KMO (0.40) KMOPTGDR2CYP1A2LMNACYP2D6
SCHEMBL29771760 0.84 KMO (0.40) KMOPTGDR2CYP1A2LMNACYP2D6
SCHEMBL2508301 0.84 KMO (0.40) KMOPTGDR2CYP1A2LMNACYP2D6
SCHEMBL2510592 0.84 PTGDR2 (0.42) KMOPTGDR2CYP1A2LMNACYP2D6

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 KMO 283/4885PTGDR2 1971/4885CYP1A2 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.