SCHEMBL13318210

SCHEMBL13318210

COC(=O)CC(C(=O)O)c1ccc(OCc2cccc(-c3ccc(C(F)(F)F)cc3)c2)cc1

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 12/20 0.68
▸ PSEN1 P49768 1/20 0.53
▸ PSEN2 P49810 1/20 0.53
▸ APH1B Q8WW43 1/20 0.53
▸ NCSTN Q92542 1/20 0.53
▸ APH1A Q96BI3 1/20 0.53
▸ PSENEN Q9NZ42 1/20 0.53
▸ MRGPRX4 Q96LA9 1/20 0.52
▸ GPR34 Q9UPC5 1/20 0.51
▸ PPARD Q03181 3/20 0.50
▸ PPARA Q07869 2/20 0.50
▸ ADAMTS4 O75173 1/20 0.50
▸ MMP13 P45452 1/20 0.50
▸ ADAMTS5 Q9UNA0 1/20 0.50
▸ PPARG P37231 1/20 0.49
▸ RXRA P19793 1/20 0.47
▸ NR1H2 P55055 1/20 0.47
▸ NR1H3 Q13133 1/20 0.47

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
SCHEMBL12020986 1.00 FFAR1 (0.68) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL12021108 0.91 FFAR1 (0.64) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL3523470 0.91 FFAR1 (0.66) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL12021068 0.91 FFAR1 (0.63) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL13550323 0.90 FFAR1 (0.79) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL13318254 0.90 FFAR1 (0.62) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL14286071 0.90 FFAR1 (0.62) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL14286192 0.90 FFAR1 (0.62) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL13318209 0.87 FFAR1 (0.59) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL13550339 0.86 FFAR1 (0.74) FFAR1MRGPRX4PPARDPPARAPPARG

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-20100137323-A1 BENZO-FUSED COMPOUNDS FOR USE IN TREATING METABOLIC DISORDERS AMGEN INC. (US) 2010-06-03 — — US disclosed
US-20100137323-A1 BENZO-FUSED COMPOUNDS FOR USE IN TREATING METABOLIC DISORDERS AMGEN INC. (US) 2010-06-03 — — US disclosed
US-7687526-B2 Benzo-fused compounds for use in treating metabolic disorders AMGEN INC. (US) 2010-03-30 — — US disclosed
US-7687526-B2 Benzo-fused compounds for use in treating metabolic disorders AMGEN INC. (US) 2010-03-30 — — US disclosed
US-20080119511-A1 Benzo-fused compounds for use in treating metabolic disorders AMGEN INC. (US) 2008-05-22 — — US disclosed
US-20080119511-A1 Benzo-fused compounds for use in treating metabolic disorders AMGEN INC. (US) 2008-05-22 — — 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 (2 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-20080119511-A1 Benzo-fused compounds for use in treating metabolic disorders GOT2, PC, GLS2 FFAR1 549/4885PSEN1 1251/4885PSEN2 782/4885
US-20100137323-A1 BENZO-FUSED COMPOUNDS FOR USE IN TREATING METABOLIC DISORDERS GOT2, GLS2, PC FFAR1 699/4885PSEN1 1028/4885PSEN2 823/4885

“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.

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