SCHEMBL2721201

SCHEMBL2721201

Cc1cc(C2CCC(c3ccc(OCCCCCO)cc3)CC2)ccc1OCCCCCO

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 7/20 0.44
▸ TLR8 Q9NR97 1/20 0.42
▸ HRH3 Q9Y5N1 4/20 0.41
▸ KCNH2 Q12809 3/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ SSTR4 P31391 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ PPARG P37231 2/20 0.39
▸ PPARA Q07869 2/20 0.39
▸ MRGPRX4 Q96LA9 1/20 0.38
▸ PPARD Q03181 1/20 0.38

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
SCHEMBL2720234 1.00 MCHR1 (0.44) MCHR1TLR8HRH3KCNH2CYP3A4
SCHEMBL2718213 1.00 MCHR1 (0.44) MCHR1TLR8HRH3KCNH2CYP3A4
SCHEMBL2719918 0.99 MCHR1 (0.45) MCHR1TLR8HRH3KCNH2CYP3A4
SCHEMBL2717625 0.95 MCHR1 (0.46) MCHR1HRH3KCNH2CYP3A4CYP2C9
SCHEMBL2717711 0.91 MCHR1 (0.47) MCHR1HRH3KCNH2CYP3A4CYP2C9
SCHEMBL2719574 0.85 HRH3 (0.51) HRH3KCNH2CYP3A4CYP2C9RAB9A
SCHEMBL2720561 0.85 HRH3 (0.51) HRH3KCNH2CYP3A4CYP2C9RAB9A
SCHEMBL2721397 0.85 HRH3 (0.51) HRH3KCNH2CYP3A4CYP2C9RAB9A
SCHEMBL2720511 0.84 MCHR1 (0.40) MCHR1HRH3KCNH2CYP3A4CYP2C9
SCHEMBL2720762 0.84 MCHR1 (0.40) MCHR1HRH3KCNH2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1995245-B1 METHOD FOR PRODUCING EPOXY COMPOUND SUMITOMO CHEMICAL CO (JP) 2012-05-02 — — EP disclosed
US-20090054669-A1 Process For Producing Epoxy Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-02-26 — — US disclosed
EP-1995245-A1 METHOD FOR PRODUCING EPOXY COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-11-26 — — 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-20090054669-A1 Process For Producing Epoxy Compound RER1, AR, CYP1A1 MCHR1 621/4885TLR8 3905/4885HRH3 19/4885

“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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