SCHEMBL2030814

SCHEMBL2030814

CCCC/C=C/c1cc(O)cc(O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 2/20 0.50
▸ PTGS2 P35354 5/20 0.44
▸ CYP3A4 P08684 3/20 0.44
▸ KDM4E B2RXH2 3/20 0.42
▸ LMNA P02545 3/20 0.42
▸ CA12 O43570 2/20 0.42
▸ CA1 P00915 2/20 0.42
▸ CA2 P00918 2/20 0.42
▸ CA3 P07451 2/20 0.42
▸ CA4 P22748 2/20 0.42
▸ CA6 P23280 2/20 0.42
▸ CA5A P35218 2/20 0.42
▸ CA7 P43166 2/20 0.42
▸ CA9 Q16790 2/20 0.42
▸ CA13 Q8N1Q1 2/20 0.42
▸ CA14 Q9ULX7 2/20 0.42
▸ CA5B Q9Y2D0 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ TP53 P04637 2/20 0.42

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
SCHEMBL2030815 1.00 LCK (0.50) LCKPTGS2CYP3A4KDM4ELMNA
SCHEMBL7645028 0.96 LCK (0.44) LCKPTGS2CYP3A4CA12CA1
SCHEMBL10296725 0.94 LCK (0.48) LCKPTGS2CYP3A4ALOX5CBS
SCHEMBL11296041 0.92 PTGS2 (0.48) LCKPTGS2CYP3A4ALOX5CBS
SCHEMBL16535327 0.92 PTGS2 (0.48) LCKPTGS2CYP3A4ALOX5CBS
SCHEMBL2464261 0.92 PTGS2 (0.48) LCKPTGS2CYP3A4ALOX5CBS
SCHEMBL2370035 0.92 PTGS2 (0.48) LCKPTGS2CYP3A4ALOX5CBS
SCHEMBL17938807 0.92 PTGS2 (0.48) LCKPTGS2CYP3A4ALOX5CBS
SCHEMBL17938809 0.92 PTGS2 (0.48) LCKPTGS2CYP3A4ALOX5CBS
SCHEMBL17938768 0.92 PTGS2 (0.48) LCKPTGS2CYP3A4ALOX5CBS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8258322-B2 Synthesis of hexahydrodibenzopyranones WATSON LABORATORIES, INC. (US) 2012-09-04 — — US disclosed
EP-2331519-A1 IMPROVED SYNTHESIS OF HEXAHYDRODIBENZOPYRANONES Watson Laboratories, Inc. (US) 2011-06-15 — — EP disclosed
US-20100056811-A1 Synthesis of Hexahydrodibenzopyranones WATSON LABORATORIES, INC. 2010-03-04 — — US disclosed
WO-2010022520-A1 IMPROVED SYNTHESIS OF HEXAHYDRODIBENZOPYRANONES DALTON CHEMICAL LABORATORIES INC. (CA) 2010-03-04 — — WO disclosed
EP-0004753-B1 PREPARATION OF TETRAHYDROBENZOXOCINS AND CIS-HEXAHYDRODIBENZOPYRANONES ELI LILLY AND COMPANY (US) 1982-05-26 — — EP disclosed
EP-0004753-A1 Preparation of tetrahydrobenzoxocins and cis-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1979-10-17 — — EP disclosed
US-4171315-A Preparation of cis-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1979-10-16 — — US disclosed
US-4148809-A Process for preparing dl-cis-1-hydroxy-3-substituted-6,6-dimethyl-6,6a,7,8,10,10a-hexahydro-9H-dibenzo[b,d]pyran-9-ones ELI LILLY AND COMPANY (US) 1979-04-10 — — US disclosed
US-4131614-A Process for preparing cis-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1978-12-26 — — 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-20100056811-A1 Synthesis of Hexahydrodibenzopyranones GNE, GALE, UGDH LCK 3375/4885PTGS2 1512/4885CYP3A4 86/4885

“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.

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