SCHEMBL24272024

SCHEMBL24272024

Cc1nc(COc2ncc(C(F)(F)F)cn2)sc1-c1cccc(-c2ccc(C(=O)O)cc2)n1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BPGM P07738 2/20 0.50
▸ GPR52 Q9Y2T5 8/20 0.47
▸ PPARD Q03181 6/20 0.41
▸ NR4A2 P43354 1/20 0.39
▸ MRGPRX4 Q96LA9 1/20 0.39
▸ RARA P10276 1/20 0.39
▸ RARB P10826 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL24272263 0.89 MRGPRX4 (0.53) BPGMGPR52PPARDMRGPRX4
SCHEMBL24271932 0.87 BPGM (0.63) BPGMGPR52PPARDRARARARB
SCHEMBL24271765 0.83 MRGPRX4 (0.53) BPGMGPR52PPARDNR4A2MRGPRX4
SCHEMBL24272260 0.81 BPGM (0.43) BPGMGPR52PPARDMRGPRX4RARA
SCHEMBL24271780 0.80 GPR52 (0.44) BPGMGPR52RARARARBKDM4E
SCHEMBL24271784 0.79 ALDH1A1 (0.42) BPGMGPR52PPARDRARARARB
SCHEMBL24272267 0.79 BPGM (0.51) BPGMPPARDRARARARBKDM4E
SCHEMBL24271783 0.77 BPGM (0.45) BPGMGPR52PPARDRARARARB
SCHEMBL24271778 0.77 BPGM (0.42) BPGMGPR52PPARDRARARARB
SCHEMBL24271922 0.76 BPGM (0.57) BPGMGPR52PPARDKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348450-A1 CARBOXYLIC ACID-CONTAINING COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE GENZYME CORPORATION 2023-11-02 — — US disclosed
US-20230348450-A1 CARBOXYLIC ACID-CONTAINING COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE GENZYME CORPORATION 2023-11-02 — — US disclosed
WO-2022056447-A1 CARBOXYLIC ACID-CONTAINING COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE GENZYME CORPORATION (US) 2022-03-17 — — 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 (1 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-20230348450-A1 CARBOXYLIC ACID-CONTAINING COMPOUNDS AS MODULATORS OF BIS-PHOSPHOGLYCERATE MUTASE FOR THE TREATMENT OF SICKLE CELL DISEASE BPGM, PGAM1, PGM2 BPGM 1/4885GPR52 2667/4885PPARD 1088/4885

“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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