SCHEMBL5114439

SCHEMBL5114439

Cc1cccc(Oc2cc(C)c(-c3cccc(CO)c3)c(C)c2)n1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.56
NR1H2 P55055 2/20 0.44
NR1H3 Q13133 2/20 0.44
PRKCI P41743 1/20 0.39
KDR P35968 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
MAP2K4 P45985 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
HTR7 P34969 1/20 0.36
DHODH Q02127 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
SCHEMBL1011422 0.82 F10 (0.46) FFAR1NR1H2NR1H3KDRPPARG
SCHEMBL3631260 0.77 FFAR1 (0.47) FFAR1PPARG
SCHEMBL31538464 0.76 LTA4H (0.50) FFAR1PPARG
SCHEMBL3451644 0.74 PRKCI (0.49) FFAR1NR1H2NR1H3PRKCIMAP2K4
SCHEMBL1508340 0.74 HTR7 (0.59) FFAR1NR1H2NR1H3PRKCIMAP2K4
Amelenodor SCHEMBL22061849 0.73 CCR1 (0.44) FFAR1PPARG
SCHEMBL5107947 0.73 FYN (0.53) FFAR1NR1H2NR1H3
SCHEMBL3450142 0.73 FFAR1 (0.65) FFAR1
Hydrochloric Acid SCHEMBL5108499 0.73 FFAR1 (1.00) FFAR1
SCHEMBL12577783 0.73 FFAR1 (0.44) FFAR1NR1H2NR1H3

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-7456218-B2 3-(4-benzyloxyphenyl) propanoic acid derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-25 US disclosed
US-7456218-B2 3-(4-benzyloxyphenyl) propanoic acid derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-25 US disclosed
US-7456218-B2 3-(4-benzyloxyphenyl) propanoic acid derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-25 US disclosed
US-20070149608-A1 3-(4-Benzyloxyphenyl) propanoic acid derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-06-28 US disclosed
US-20070149608-A1 3-(4-Benzyloxyphenyl) propanoic acid derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-06-28 US disclosed
US-20070149608-A1 3-(4-Benzyloxyphenyl) propanoic acid derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-06-28 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-20070149608-A1 3-(4-Benzyloxyphenyl) propanoic acid derivatives GPR119, GPR55, GLP1R FFAR1 5/4885NR1H2 351/4885NR1H3 561/4885

“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.