SCHEMBL6884651

SCHEMBL6884651

CONC(=O)Cc1ccc2cc(OC)ccc2c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.67
▸ AKR1C3 P42330 1/20 0.67
▸ AKR1C2 P52895 1/20 0.67
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ CYP3A4 P08684 2/20 0.55
▸ MAPT P10636 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ NPC1 O15118 1/20 0.55
▸ LMNA P02545 1/20 0.55
▸ TP53 P04637 1/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ MAOA P21397 1/20 0.55
▸ SLC6A2 P23975 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ SLC6A3 Q01959 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ HTT P42858 1/20 0.54
▸ POLB P06746 2/20 0.52
▸ PPARG P37231 1/20 0.52

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
SCHEMBL6885712 0.87 PTGS1 (0.61) PTGS1AKR1C3AKR1C2MEN1KMT2A
SCHEMBL6879872 0.86 PTGS1 (0.69) PTGS1AKR1C3AKR1C2MEN1KMT2A
SCHEMBL4928502 0.85 HTT (0.73) MEN1KMT2AMAPTNPC1LMNA
SCHEMBL11278088 0.83 PTGS1 (0.65) PTGS1AKR1C3AKR1C2MEN1KMT2A
SCHEMBL6884401 0.82 PTGS1 (0.73) PTGS1AKR1C3AKR1C2MEN1KMT2A
SCHEMBL1448732 0.82 PTGS1 (0.73) PTGS1AKR1C3AKR1C2MEN1KMT2A
Methane SCHEMBL9087821 0.81 PTGS1 (0.71) PTGS1AKR1C3AKR1C2MEN1KMT2A
SCHEMBL6885747 0.81 PTGS1 (0.61) PTGS1AKR1C3AKR1C2MEN1KMT2A
SCHEMBL10587711 0.81 PTGS1 (0.70) PTGS1AKR1C3AKR1C2MEN1KMT2A
6-Methoxy-2-Naphthylacetic Acid SCHEMBL253759 0.80 AKR1C3 (1.00) PTGS1AKR1C3AKR1C2CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6730701-B2 6-METHOXY-2-NAPHTHYLACETIC ACID DERIVATIVE AS A PRODRUGS, USEFUL FOR TREATMENT OF INFLAMMATION IN HUMANS NOBEX CORPORATION 2004-05-04 — — US disclosed
EP-1335718-A1 6-METHOXY-2-NAPHTHYLACETIC ACID PRODRUGS Nobex Corporation (US) 2003-08-20 — — EP disclosed
US-20030100606-A1 6-methoxy-2-naphthylacetic acid derivative as a prodrugs, useful for treatment of inflammation in humans BIOCON LIMITED (IN) 2003-05-29 — — US disclosed
US-6552078-B2 Antiinflammatory and antiarthritic agents; rheumatic diseases; side effect reduction; ulcer and allergy resistance; non-irritating; easily hydrolyzed and solubilized; bioavailability BIOCON LIMITED (IN) 2003-04-22 — — US disclosed
WO-2002034260-A1 6-METHOXY-2-NAPHTHYLACETIC ACID PRODRUGS NOBEX CORPORATION (US) 2002-05-02 — — WO disclosed
US-20020028845-A1 6-methoxy-2-naphthylacetic acid prodrugs BIOCON LIMITED (IN) 2002-03-07 — — 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 (2 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-20020028845-A1 6-methoxy-2-naphthylacetic acid prodrugs IL6, CYP2A6, TLR6 PTGS1 648/4885AKR1C3 64/4885AKR1C2 179/4885
US-20030100606-A1 6-methoxy-2-naphthylacetic acid derivative as a prodrugs, useful for treatment of inflammation in humans IL6, IL1A, CYP2A6 PTGS1 538/4885AKR1C3 55/4885AKR1C2 154/4885

“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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