SCHEMBL11462290

SCHEMBL11462290

C=Cc1ccc2cc(C(C)C(=O)OC)ccc2c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ PTGS2 P35354 6/20 0.47
▸ AKR1C3 P42330 5/20 0.47
▸ AKR1C2 P52895 5/20 0.47
▸ PTGS1 P23219 3/20 0.47
▸ TSHR P16473 2/20 0.47
▸ CDC42 P60953 1/20 0.47
▸ RAC1 P63000 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ SLC22A6 Q4U2R8 1/20 0.47
▸ LMNA P02545 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ MT-CO2 P00403 1/20 0.44
▸ TAS1R3 Q7RTX0 1/20 0.42
▸ TAS1R1 Q7RTX1 1/20 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
SCHEMBL18770095 1.00 TDP1 (0.50) TDP1L3MBTL1PTGS2AKR1C3AKR1C2
SCHEMBL28351309 0.84 TAS1R3 (0.51) PTGS2PTGS1MT-CO2TAS1R3TAS1R1
SCHEMBL11476903 0.83 PTGS2 (0.58) PTGS2AKR1C3AKR1C2PTGS1TSHR
SCHEMBL30882142 0.82 PTGS2 (0.43) PTGS2AKR1C3AKR1C2PTGS1TSHR
SCHEMBL29226110 0.82 PTGS2 (0.43) PTGS2AKR1C3AKR1C2PTGS1TSHR
SCHEMBL11764188 0.79 PTGS2 (0.55) PTGS2AKR1C3AKR1C2PTGS1TSHR
SCHEMBL11719691 0.79 PTGS2 (0.42) TDP1L3MBTL1PTGS2AKR1C3AKR1C2
SCHEMBL11742200 0.79 PTGS2 (0.57) PTGS2AKR1C3AKR1C2PTGS1TSHR
SCHEMBL505819 0.78 TDP1 (0.77) TDP1L3MBTL1PTGS2AKR1C3AKR1C2
SCHEMBL505811 0.78 TDP1 (0.77) TDP1L3MBTL1PTGS2AKR1C3AKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230039244-A1 2-BETA-NAPHTHYL-ACETIC ACID ANALOGS AS AKR1C3 INHIBITORS AND METHODS OF USING SAME UNIV PENNSYLVANIA (US) 2023-02-09 — — US disclosed
US-11459295-B2 2-beta-naphthyl-acetic acid analogs as AKR1C3 inhibitors and methods of using same THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2022-10-04 — — US disclosed
US-20180305305-A1 2-BETA-NAPHTHYL-ACETIC ACID ANALOGS AS AKR1C3 INHIBITORS AND METHODS OF USING SAME THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2018-10-25 — — US disclosed
WO-2017070448-A1 2-BETA-NAPHTHYL-ACETIC ACID ANALOGS AS AKR1C3 INHIBITORS AND METHODS OF USING SAME THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2017-04-27 — — WO disclosed
US-4207241-A ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS AND ANTIPRURITIC AGENTS SYNTEX CORPORATION (US) 1980-06-10 — — US disclosed
US-4097674-A ANTIINFLAMMATORY, ANTIPYRETIC, ANTIPRURITIC AGENTS, ANALGESICS SYNTEX CORPORATION (US) 1978-06-27 — — US disclosed
US-4051233-A ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC, ANTIPRURITIC SYNTEX CORPORATION (US) 1977-09-27 — — US disclosed
US-4001301-A ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS, ANTI-PRURITIC SYNTEX CORPORATION (PM) 1977-01-04 — — US disclosed
US-3998966-A Anti-inflammatory, analgesic, anti-pyretic and anti-pruritic 6-substituted 2-naphthyl acetic acid derivative-containing compositions and methods of use thereof SYNTEX CORPORATION (PM) 1976-12-21 — — US disclosed
US-3980699-A ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETIC, ANTIPRURITIC SYNTEX CORPORATION (PM) 1976-09-14 — — US disclosed
US-3978116-A ANALGESIC, ANTIPYRETIC SYNTEX CORPORATION (PM) 1976-08-31 — — US disclosed
US-3978124-A ANALGESIC, ANTIPYRETIC SYNTEX CORPORATION (PM) 1976-08-31 — — 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 (3 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-11459295-B2 2-beta-naphthyl-acetic acid analogs as AKR1C3 inhibitors and methods of using same AKR1C3, AKR1C2, AKR1A1 TDP1 2069/4885L3MBTL1 4757/4885PTGS2 294/4885
US-20180305305-A1 2-BETA-NAPHTHYL-ACETIC ACID ANALOGS AS AKR1C3 INHIBITORS AND METHODS OF USING SAME AKR1C3, AKR1C2, AKR1A1 TDP1 2069/4885L3MBTL1 4757/4885PTGS2 294/4885
US-20230039244-A1 2-BETA-NAPHTHYL-ACETIC ACID ANALOGS AS AKR1C3 INHIBITORS AND METHODS OF USING SAME AKR1C3, AKR1C2, AKR1A1 TDP1 2106/4885L3MBTL1 4746/4885PTGS2 261/4885

“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.

Send feedback