SCHEMBL22229451

SCHEMBL22229451

N#Cc1cc(Br)ccc1CC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
GRIK1 P39086 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
ABCB11 O95342 1/20 0.37
LMNA P02545 1/20 0.37
PTGS1 P23219 1/20 0.37
ADORA1 P30542 1/20 0.37
PTGS2 P35354 1/20 0.37
AKR1B1 P15121 2/20 0.36
MPO P05164 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SRC P12931 1/20 0.36
CHEK1 O14757 1/20 0.35

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
SCHEMBL4941838 0.83 AKR1B1 (0.38) GRIK1PTGDR2ABCB11LMNAPTGS1
SCHEMBL23599468 0.81 MAPT (0.43) LMNASMN1; SMN2GAA
SCHEMBL11213637 0.81 FFAR1 (0.45) RXRARXRBRXRGPTGDR2LMNA
SCHEMBL15825033 0.79 KDM4E (0.42) RXRARXRBRXRGPTGDR2LMNA
SCHEMBL18471266 0.79 TSHR (0.46) RXRARXRBRXRGPTGDR2AKR1B1
SCHEMBL20772954 0.79 NLRP3 (0.41) LMNASMN1; SMN2GAAMEN1KMT2A
SCHEMBL3273772 0.78 MPO (0.39) LMNAMPOSMN1; SMN2GAAMEN1
SCHEMBL31434232 0.78 MAOB (0.40) PTGDR2MPOSMN1; SMN2GAA
SCHEMBL17289808 0.78 MPO (0.39) LMNAMPOCHEK1
SCHEMBL4944816 0.76 AKR1B1 (0.37) GRIK1PTGDR2ABCB11LMNAPTGS1

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-12145924-B2 Lysophosphatidic acid receptor 1 (LPAR1) inhibitor compounds ELI LILLY AND COMPANY (US) 2024-11-19 US disclosed
EP-3679032-B1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS LILLY CO ELI (US) 2023-10-04 EP disclosed
CN-111032647-B Lysophosphatidic acid receptor 1 (LPAR 1) inhibitor compounds 伊莱利利公司 2023-05-02 CN disclosed
US-20220281845-A1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS ELI LILLY AND COMPANY 2022-09-08 US disclosed
US-11365185-B2 Lysophosphatidic acid receptor 1 (LPAR1) inhibitor compounds ELI LILLY AND COMPANY (US) 2022-06-21 US disclosed
US-20200231568-A1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS ELI LILLY AND COMPANY 2020-07-23 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 (4 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-20220281845-A1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS LPAR1, LPAR2, LPAR5 RXRA 1910/4885RXRB 1875/4885RXRG 1963/4885
US-12145924-B2 Lysophosphatidic acid receptor 1 (LPAR1) inhibitor compounds LPAR1, LPAR2, LPAR5 RXRA 1910/4885RXRB 1875/4885RXRG 1963/4885
US-20200231568-A1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS LPAR1, LPAR2, LPAR3 RXRA 1849/4885RXRB 1875/4885RXRG 1927/4885
US-11365185-B2 Lysophosphatidic acid receptor 1 (LPAR1) inhibitor compounds LPAR1, LPAR2, LPAR3 RXRA 1849/4885RXRB 1875/4885RXRG 1927/4885

“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.