SCHEMBL7642234

SCHEMBL7642234

CC(CC(=O)c1c(F)ccc(-c2ccccc2)c1F)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ AKR1C3 P42330 3/20 0.46
▸ AKR1C2 P52895 3/20 0.46
▸ PTGS2 P35354 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ FABP2 P12104 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ AKR1C4 P17516 1/20 0.46
▸ ADRA2B P18089 1/20 0.46
▸ CHRM3 P20309 1/20 0.46
▸ HTR2C P28335 1/20 0.46
▸ DRD3 P35462 1/20 0.46
▸ AKR1C1 Q04828 1/20 0.46
▸ SLC22A6 Q4U2R8 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ HPGD P15428 1/20 0.46

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
SCHEMBL9195441 0.87 MEN1 (0.36) PTGS1KMT2AMEN1AKR1C3AKR1C2
SCHEMBL9195448 0.87 SMN1; SMN2 (0.36) PTGS1KMT2AMEN1AKR1C3AKR1C2
SCHEMBL9705872 0.77 FFAR1 (0.47) PTGS1KMT2AMEN1AKR1C3AKR1C2
SCHEMBL9617615 0.76 PTGES (0.39) PTGS1KMT2AMEN1AKR1C3AKR1C2
SCHEMBL20773094 0.75 CDK1 (0.44) PTGS1KMT2AMEN1AKR1C3AKR1C2
SCHEMBL10790397 0.75 STING1 (0.39) PTGS1KMT2AMEN1AKR1C3AKR1C2
SCHEMBL7505997 0.74 HDAC3 (0.46) LMNAMAPTCYP1A2HPGDHIF1A
SCHEMBL7503214 0.74 HDAC3 (0.42) LMNACYP1A2HIF1AFFAR1SMN1; SMN2
SCHEMBL10871117 0.73 KMT2A (0.49) KMT2AMEN1LMNAMAPTTSHR
SCHEMBL28329663 0.72 BCAT2 (0.47) PTGS1KMT2AMEN1AKR1C3AKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0465879-B1 Derivatives of 4-(2,4-difluoro-biphenylyl)-2-methyl-4-oxo-butanoic acid VYZK USTAV FARM BIOCHEM SP (CS) 1995-11-29 — — EP claimed
US-5177204-A Antiinflammatory agents Vyzkumng, USTAV pro farmacii a biochemii, Statni podnik (CS) 1993-01-05 — — US claimed
EP-0465879-A1 Derivatives of 4-(2,4-difluoro-biphenylyl)-2-methyl-4-oxo-butanoic acid VYZKUMNY USTAV PRO FARMACII A BIOCHEMII STATNI PODNIK (CS) 1992-01-15 — — EP claimed
EP-0180290-B1 OMEGA-(2',4'-DIHALOBIPHENYLYL)OXO ALKANOIC ACIDS AND PROCESS FOR THEIR PREPARATION SPOFA Spojené Podniky Pro Zdravotnickou Vyrobu (CS) 1987-10-28 — — EP claimed
EP-0180290-A1 Omega-(2',4'-dihalobiphenylyl)oxo alkanoic acids and process for their preparation SPOFA Spojené Podniky Pro Zdravotnickou Vyrobu (CS) 1986-05-07 — — EP claimed
EP-0790974-B1 SUBSTITUTED 4-BIARYLBUTYRIC OR 5-BIARYLPENTANOIC ACIDS AND DERIVATIVES AS MATRIX METALLOPROTEASE INHIBITIORS BAYER AG (US) 2002-08-14 — — EP disclosed
EP-0465879-B1 Derivatives of 4-(2,4-difluoro-biphenylyl)-2-methyl-4-oxo-butanoic acid VYZK USTAV FARM BIOCHEM SP (CS) 1995-11-29 — — EP disclosed
EP-0465879-B1 Derivatives of 4-(2,4-difluoro-biphenylyl)-2-methyl-4-oxo-butanoic acid VYZK USTAV FARM BIOCHEM SP (CS) 1995-11-29 — — EP disclosed
US-5177204-A Antiinflammatory agents Vyzkumng, USTAV pro farmacii a biochemii, Statni podnik (CS) 1993-01-05 — — US disclosed
US-5177204-A Antiinflammatory agents Vyzkumng, USTAV pro farmacii a biochemii, Statni podnik (CS) 1993-01-05 — — US disclosed
US-5177204-A Antiinflammatory agents Vyzkumng, USTAV pro farmacii a biochemii, Statni podnik (CS) 1993-01-05 — — US disclosed
EP-0465879-A1 Derivatives of 4-(2,4-difluoro-biphenylyl)-2-methyl-4-oxo-butanoic acid VYZKUMNY USTAV PRO FARMACII A BIOCHEMII STATNI PODNIK (CS) 1992-01-15 — — EP disclosed
EP-0465879-A1 Derivatives of 4-(2,4-difluoro-biphenylyl)-2-methyl-4-oxo-butanoic acid VYZKUMNY USTAV PRO FARMACII A BIOCHEMII STATNI PODNIK (CS) 1992-01-15 — — EP disclosed
EP-0465879-A1 Derivatives of 4-(2,4-difluoro-biphenylyl)-2-methyl-4-oxo-butanoic acid VYZKUMNY USTAV PRO FARMACII A BIOCHEMII STATNI PODNIK (CS) 1992-01-15 — — EP disclosed
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