SCHEMBL29673221

SCHEMBL29673221

NC(=O)NCc1ccc(F)c(F)c1F

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.56
P2RX7 Q99572 18/20 0.48
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL29788857 0.81 CA2 (0.52) CA2P2RX7
SCHEMBL7976991 0.77 CYP2C9 (0.54) P2RX7CYP2C9CYP2C19
SCHEMBL626266 0.76 P2RX7 (0.49) P2RX7
SCHEMBL7137210 0.76 MAPK8 (0.49) CYP2C9CYP2C19
SCHEMBL28170737 0.76 P2RX7 (0.53) CA2P2RX7
SCHEMBL5527359 0.76 ALDH1A1 (0.59)
SCHEMBL30572329 0.76 MPO (0.46) CA2P2RX7
SCHEMBL14431727 0.75 CYP2C9 (0.47) CYP2C9CYP2C19
SCHEMBL12366166 0.75 P2RX7 (0.49) CA2P2RX7
SCHEMBL2263310 0.75 MCL1 (0.51) CA2P2RX7

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
CN-117466803-A Compounds, salts thereof and methods for treating diseases 阿卡蒂亚药品公司 2024-01-30 CN disclosed
CN-111132976-B Compounds, salts thereof and methods for treating diseases 阿卡蒂亚药品公司 2023-08-22 CN disclosed
US-11345693-B2 Compounds, salts thereof and methods for treatment of diseases ACADIA PHARMACEUTICALS INC. (US) 2022-05-31 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 (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-11345693-B2 Compounds, salts thereof and methods for treatment of diseases SLC10A1, CYP27A1, CYP11B2 CA2 1024/4885P2RX7 2574/4885CYP2C9 384/4885

“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.