SCHEMBL3879416

SCHEMBL3879416

CCC[C@H](CC(=O)O)c1ccc(O)c(Br)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.47
ESR1 P03372 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
FOLH1 Q04609 1/20 0.39
ESR2 Q92731 1/20 0.37
LMNA P02545 3/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GABBR2 O75899 4/20 0.36
GABBR1 Q9UBS5 4/20 0.36
CYP2C9 P11712 2/20 0.36
FFAR1 O14842 1/20 0.36
CYP3A4 P08684 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
NFKB1 P19838 1/20 0.36
DRD3 P35462 1/20 0.36
BLM P54132 1/20 0.36

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
SCHEMBL17262511 0.85 FFAR1 (0.41) GAAMEN1KMT2ALMNANPSR1
SCHEMBL3873634 0.85 GAA (0.47) GAAESR1MEN1KMT2AESR2
SCHEMBL13715459 0.84 FOLH1 (0.42) GAAESR1MEN1KMT2AFOLH1
SCHEMBL2498025 0.82 TRPA1 (0.46) GAAESR1MEN1KMT2AESR2
SCHEMBL2502889 0.82 TRPA1 (0.46) GAAESR1MEN1KMT2AESR2
SCHEMBL2501254 0.81 ADRB1 (0.43) GAAESR1MEN1KMT2AESR2
SCHEMBL2495292 0.81 ADRB1 (0.43) GAAESR1MEN1KMT2AESR2
SCHEMBL11528740 0.80 ALOX15 (0.42) GAAESR1MEN1KMT2AFOLH1
SCHEMBL3872457 0.79 ESR1 (0.59) GAAESR1MEN1KMT2AESR2
SCHEMBL3879432 0.79 ESR1 (0.59) GAAESR1MEN1KMT2AESR2

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-2139843-B1 SUBSTITUTED BIPHENYL PHENOXY-, THIOPHENYL- AND AMINOPHENYLPROPANOIC ACID GPR40 MODULATORS AMGEN INC (US) 2013-12-25 EP disclosed
US-7572934-B2 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-08-11 US disclosed
US-20090111859-A1 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-04-30 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 (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-20090111859-A1 Substituted biphenyl GPR40 modulators GPR119, GPR65, GPR55 GAA 1114/4885ESR1 173/4885MEN1 3240/4885

“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.