SCHEMBL3815581

SCHEMBL3815581

CC(C)(C)c1cc(O)ccc1C1=CCC(c2ccc(O)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 19/20 0.39
▸ CYP2C9 P11712 2/20 0.38
▸ NR1I2 O75469 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MIF P14174 1/20 0.38
▸ TYR P14679 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ NFE2L2 Q16236 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ ESR1 P03372 4/20 0.32
▸ CYP3A4 P08684 1/20 0.32

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
SCHEMBL3809156 0.85 ESR2 (0.35) ESR2CYP2C9NR1I2ALDH1A1LMNA
SCHEMBL2717182 0.85 ESR2 (0.41) ESR2CYP2C9ALDH1A1ESR1CYP3A4
SCHEMBL3807425 0.83 ESR2 (0.40) ESR2CYP2C9ESR1CYP3A4
SCHEMBL3816901 0.80 ALDH1A1 (0.43) ESR2CYP2C9NR1I2ALDH1A1LMNA
SCHEMBL3809720 0.79 ESR2 (0.42) ESR2CYP2C9ESR1CYP3A4
SCHEMBL3811414 0.78 CYP1A2 (0.47) ESR2CYP2C9ALDH1A1TYR
SCHEMBL3818232 0.78 ESR2 (0.37) ESR2CYP2C9ESR1CYP3A4
SCHEMBL3807529 0.77 ESR2 (0.40) ESR2CYP2C9ALDH1A1ALOX15HSD17B10
SCHEMBL3815323 0.77 ESR2 (0.39) ESR2CYP2C9ESR1CYP3A4
SCHEMBL27831224 0.76 ALOX5 (0.41) ESR2CYP2C9ESR1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1375461-B1 DIPHENOL AND PROCESS FOR PRODUCING THE SAME HONSHU CHEMICAL IND (JP) 2009-08-05 — — EP disclosed
US-6872858-B2 Diphenol and process for producing the same HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2005-03-29 — — US disclosed
US-20040049086-A1 Diphenol and process for producing the same HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2004-03-11 — — US disclosed
EP-1375461-A1 DIPHENOL AND PROCESS FOR PRODUCING THE SAME Honshu Chemical Industry Co. Ltd. (JP) 2004-01-02 — — EP 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-20040049086-A1 Diphenol and process for producing the same CYP1A1, AHR, CYP2E1 ESR2 940/4885CYP2C9 140/4885NR1I2 159/4885

“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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