SCHEMBL3552104

SCHEMBL3552104

Cn1nccc1[C@H](CC(=O)O)c1ccc(OCc2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 18/20 0.45
PPARG P37231 1/20 0.44
CYP26A1 O43174 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP26B1 Q9NR63 1/20 0.43

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
SCHEMBL3547429 1.00 FFAR1 (0.45) FFAR1PPARGCYP26A1CYP3A4CYP26B1
SCHEMBL3547432 1.00 FFAR1 (0.45) FFAR1PPARGCYP26A1CYP3A4CYP26B1
SCHEMBL14286052 0.89 FFAR1 (0.40) FFAR1
SCHEMBL3553177 0.86 FFAR1 (0.59) FFAR1PPARG
SCHEMBL3551228 0.86 FFAR1 (0.49) FFAR1PPARGCYP26A1CYP3A4CYP26B1
SCHEMBL3551231 0.86 FFAR1 (0.49) FFAR1PPARGCYP26A1CYP3A4CYP26B1
SCHEMBL3553172 0.86 FFAR1 (0.59) FFAR1PPARG
SCHEMBL13318446 0.85 FFAR1 (0.56) FFAR1PPARGCYP26A1CYP3A4CYP26B1
SCHEMBL13318270 0.85 FFAR1 (0.56) FFAR1PPARGCYP26A1CYP3A4CYP26B1
SCHEMBL3547501 0.84 FFAR1 (0.49) FFAR1PPARGCYP26A1CYP3A4CYP26B1

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 9 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-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-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
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 549/4885PPARG 14/4885CYP26A1 170/4885
US-20100137323-A1 BENZO-FUSED COMPOUNDS FOR USE IN TREATING METABOLIC DISORDERS GOT2, GLS2, PC FFAR1 699/4885PPARG 16/4885CYP26A1 255/4885

“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.