SCHEMBL4759655

SCHEMBL4759655

CCOc1cccc(-c2ccc(CO)cc2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.63
RXRB P28702 1/20 0.63
SLC13A5 Q86YT5 1/20 0.54
FGFR2 P21802 2/20 0.50
FGFR3 P22607 2/20 0.50
FGFR1 P11362 1/20 0.50
FFAR1 O14842 1/20 0.49
MAP4K4 O95819 1/20 0.49
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
THRB P10828 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
DHODH Q02127 1/20 0.47
MAOB P27338 2/20 0.46
PRMT5 O14744 1/20 0.46
WDR77 Q9BQA1 1/20 0.46
BRD4 O60885 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
SCHEMBL29426410 0.84 RXRA (0.66) RXRARXRBFGFR2FGFR3FGFR1
SCHEMBL9260410 0.84 RXRA (0.66) RXRARXRBFGFR2FGFR3FGFR1
SCHEMBL4707626 0.83 RXRA (0.59) RXRARXRBSLC13A5FGFR2FGFR3
SCHEMBL2604700 0.83 MAOB (0.66) SLC13A5MAPTCYP3A4MAOB
SCHEMBL31222694 0.83 MAOB (0.66) SLC13A5MAPTCYP3A4MAOB
SCHEMBL31222693 0.83 MAOB (0.66) SLC13A5MAPTCYP3A4MAOB
SCHEMBL30338775 0.82 RXRA (0.70) RXRARXRBSLC13A5FGFR2FGFR3
SCHEMBL203120 0.82 RXRA (0.70) RXRARXRBSLC13A5FGFR2FGFR3
SCHEMBL29012837 0.82 RXRA (0.64) RXRARXRBFGFR2FGFR3FGFR1
SCHEMBL4212932 0.81 RXRA (0.69) RXRARXRBSLC13A5FFAR1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9676720-B2 Substituted biaryl compound UBE INDUSTRIES, LTD. (JP) 2017-06-13 US disclosed
US-20160213657-A1 PHARMACEUTICAL COMPOSITION FOR TREATMENT AND/OR PREVENTION OF PULMONARY DISEASE UBE INDUSTRIES, LTD. (JP) 2016-07-28 US disclosed
EP-3042656-A1 PHARMACEUTICAL COMPOSITION FOR TREATMENT AND/OR PREVENTION OF PULMONARY DISEASE UBE Industries, Ltd. (JP) 2016-07-13 EP disclosed
US-20160060221-A1 SUBSTITUTED BIARYL COMPOUND UBE INDUSTRIES, LTD. (JP) 2016-03-03 US disclosed
EP-2980075-A1 SUBSTITUTED BIARYL COMPOUND UBE Industries, Ltd. (JP) 2016-02-03 EP disclosed
EP-2001844-A2 BICYCLIC CARBOXYLIC ACID DERIVATIVES USEFUL FOR TREATING METABOLIC DISORDERS Amgen, Inc (US) 2008-12-17 EP disclosed
US-20070244155-A1 Bicyclic carboxylic acid derivatives useful for treating metabolic disorders AMGEN INC. (US) 2007-10-18 US disclosed
US-20070244155-A1 Bicyclic carboxylic acid derivatives useful for treating metabolic disorders AMGEN INC. (US) 2007-10-18 US disclosed
US-20070244155-A1 Bicyclic carboxylic acid derivatives useful for treating metabolic disorders AMGEN INC. (US) 2007-10-18 US disclosed
WO-2007106469-A2 BICYCLIC CARBOXYLIC ACID DERIVATIVES USEFUL FOR TREATING METABOLIC DISORDERS AMGEN INC. (US) 2007-09-20 WO disclosed
WO-2007106469-A2 BICYCLIC CARBOXYLIC ACID DERIVATIVES USEFUL FOR TREATING METABOLIC DISORDERS AMGEN INC. (US) 2007-09-20 WO 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-20070244155-A1 Bicyclic carboxylic acid derivatives useful for treating metabolic disorders GOT2, PC, GOT1 RXRA 528/4885RXRB 698/4885SLC13A5 1194/4885
US-20160060221-A1 SUBSTITUTED BIARYL COMPOUND FIBP, FGF2, FGFR2 RXRA 2136/4885RXRB 1976/4885SLC13A5 1176/4885
US-20160213657-A1 PHARMACEUTICAL COMPOSITION FOR TREATMENT AND/OR PREVENTION OF PULMONARY DISEASE CFTR, ADRB3, ADRB2 RXRA 412/4885RXRB 484/4885SLC13A5 1173/4885

“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.