SCHEMBL24516809

SCHEMBL24516809

COc1cc(F)c(O[C@H]2CC[C@@](C)(C(=O)O)CC2)cc1C(=O)N[C@@H]1[C@@H]2CC[C@@H](C2)[C@@H]1C(=O)Nc1ccc(F)c(S(F)(F)(F)(F)F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 19/20 1.00
ABCB11 O95342 4/20 1.00
LHCGR P22888 1/20 1.00
SCN5A Q14524 1/20 1.00
LGR4 Q9BXB1 1/20 1.00
KCNH2 Q12809 1/20 1.00
GABRB1 P18505 2/20 0.68
TBXA2R P21731 2/20 0.68
ADRA1B P35368 2/20 0.68
TSPO P30536 1/20 0.68
DRD3 P35462 1/20 0.68
SSTR4 P31391 1/20 0.68
CCKBR P32239 1/20 0.68

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
SCHEMBL26698817 1.00 RXFP1 (1.00) RXFP1ABCB11LHCGRSCN5ALGR4
SCHEMBL24515623 1.00 RXFP1 (1.00) RXFP1ABCB11LHCGRSCN5ALGR4
SCHEMBL25646985 1.00 RXFP1 (1.00) RXFP1ABCB11LHCGRSCN5ALGR4
SCHEMBL25642962 1.00 RXFP1 (1.00) RXFP1ABCB11LHCGRSCN5ALGR4
SCHEMBL26613198 1.00 RXFP1 (1.00) RXFP1ABCB11LHCGRSCN5ALGR4
SCHEMBL25642461 0.92 RXFP1 (0.85) RXFP1ABCB11LHCGRSCN5ALGR4
SCHEMBL25642789 0.90 RXFP1 (0.82) RXFP1ABCB11LHCGRSCN5ALGR4
SCHEMBL25642690 0.90 RXFP1 (0.81) RXFP1ABCB11LHCGRSCN5ALGR4
SCHEMBL26723899 0.89 RXFP1 (0.80) RXFP1ABCB11LHCGRSCN5ALGR4
SCHEMBL25642994 0.88 RXFP1 (0.91) RXFP1ABCB11LHCGRSCN5ALGR4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348363-A1 COMPOUNDS AND THEIR USE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2023-11-02 US disclosed
US-11667602-B2 Compounds and their use ASTRAZENECA AB (SE) 2023-06-06 US disclosed
US-11667602-B2 Compounds and their use ASTRAZENECA AB (SE) 2023-06-06 US disclosed
WO-2022122773-A1 4-(2-FLUORO-4-METHOXY-5-3-(((1-METHYLCYCLOBUTYL)METHYL)CARBAMOYL)BICYCLO[2.2.1]HEPTAN-2-YL)CARBAMOYL)PHENOXY)-1-METHYLCYCLOHEXANE-1-CARBOXYLIC ACID DERIVATIVES AND SIMILAR COMPOUNDS AS RXFP1 MODULATORS FOR THE TREATMENT OF HEART FAILURE ASTRAZENECA AB (SE) 2022-06-16 WO 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-11667602-B2 Compounds and their use RXFP1, RXFP3, RXFP2 RXFP1 1/4885ABCB11 1382/4885LHCGR 1872/4885
US-20230348363-A1 COMPOUNDS AND THEIR USE RXFP1, RXFP3, RXFP2 RXFP1 1/4885ABCB11 1382/4885LHCGR 1872/4885

“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.