SCHEMBL25175611

SCHEMBL25175611

O=C(O)CCc1cccc(OCCCCc2ccccc2)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 11/20 0.76
▸ CYSLTR2 Q9NS75 1/20 0.58
▸ CYSLTR1 Q9Y271 1/20 0.58
▸ S1PR1 P21453 3/20 0.58
▸ FFAR4 Q5NUL3 2/20 0.58
▸ PPARG P37231 1/20 0.57
▸ PPARA Q07869 1/20 0.57
▸ S1PR3 Q99500 1/20 0.56
▸ S1PR5 Q9H228 1/20 0.56
▸ KEAP1 Q14145 1/20 0.56
▸ MAPT P10636 1/20 0.54
▸ RXFP1 Q9HBX9 1/20 0.54
▸ HDAC3 O15379 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ ADRA1A P35348 1/20 0.53
▸ HDAC4 P56524 1/20 0.53
▸ SLC6A3 Q01959 1/20 0.53
▸ HDAC1 Q13547 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ HDAC7 Q8WUI4 1/20 0.53

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
SCHEMBL947863 0.94 FFAR1 (0.67) FFAR1CYSLTR2CYSLTR1S1PR1PPARG
SCHEMBL17413767 0.94 FFAR1 (0.71) FFAR1CYSLTR2CYSLTR1S1PR1FFAR4
SCHEMBL17413763 0.93 FFAR1 (0.69) FFAR1CYSLTR2CYSLTR1S1PR1FFAR4
SCHEMBL1746597 0.86 FFAR1 (1.00) FFAR1S1PR1FFAR4S1PR3S1PR5
SCHEMBL17345292 0.86 PPARA (0.69) FFAR1CYSLTR2CYSLTR1PPARGPPARA
SCHEMBL25456542 0.86 PPARA (0.69) FFAR1CYSLTR2CYSLTR1PPARGPPARA
SCHEMBL1206101 0.85 PPARA (0.64) FFAR1PPARGPPARA
SCHEMBL1746650 0.85 FFAR1 (0.88) FFAR1FFAR4
SCHEMBL4656572 0.85 FFAR1 (0.97) FFAR1S1PR1FFAR4S1PR3S1PR5
SCHEMBL1206748 0.84 LMNA (0.68) FFAR1FFAR4PPARGPPARA

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-11802135-B2 Lysophosphatidic acid derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-10-31 — — US disclosed
US-11802135-B2 Lysophosphatidic acid derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-10-31 — — US disclosed
US-11802135-B2 Lysophosphatidic acid derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-10-31 — — US disclosed
US-20230146210-A1 NOVEL LYSOPHOSPHATIDIC ACID DERIVATIVE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-05-11 — — US disclosed
US-20230146210-A1 NOVEL LYSOPHOSPHATIDIC ACID DERIVATIVE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-05-11 — — US disclosed
US-20230146210-A1 NOVEL LYSOPHOSPHATIDIC ACID DERIVATIVE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-05-11 — — 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-11802135-B2 Lysophosphatidic acid derivative LPAR4, LPAR2, LPAR1 FFAR1 61/4885CYSLTR2 119/4885CYSLTR1 115/4885
US-20230146210-A1 NOVEL LYSOPHOSPHATIDIC ACID DERIVATIVE LPAR4, LPAR2, LPAR1 FFAR1 56/4885CYSLTR2 129/4885CYSLTR1 123/4885

“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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