SCHEMBL25136295

SCHEMBL25136295

O=c1cc(C(F)F)[nH]c(=O)[nH]1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.44
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
YTHDF3 Q7Z739 1/20 0.39
YTHDF1 Q9BYJ9 1/20 0.39
YTHDF2 Q9Y5A9 1/20 0.39
JAK1 P23458 1/20 0.38
CYP1A2 P05177 1/20 0.35
GPR84 Q9NQS5 4/20 0.33
KDM4C Q9H3R0 1/20 0.32

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
SCHEMBL31710457 0.70
SCHEMBL5688062 0.69 YTHDF3 (0.46) CA1ALDH1A1LMNAYTHDF3YTHDF1
SCHEMBL1896344 0.67
SCHEMBL13918178 0.67
SCHEMBL16402628 0.66 CA1 (0.35) CA1CYP1A2GPR84
SCHEMBL10735065 0.65 KDM4C (0.50) CA1ALDH1A1LMNAYTHDF3YTHDF1
SCHEMBL5508748 0.62 GPR84 (0.50) CA1ALDH1A1LMNAYTHDF3YTHDF1
SCHEMBL628335 0.62 CA1 (0.44) CA1ALDH1A1LMNAYTHDF3YTHDF1
SCHEMBL60308 0.62
SCHEMBL3362001 0.62

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
EP-4370512-A1 CD38 MODULATORS AND METHODS OF USE THEREOF Cytokinetics, Inc. (US) 2024-05-22 EP disclosed
CN-117813296-A CD38 modulators and methods of use thereof 赛特凯恩蒂克公司 2024-04-02 CN disclosed
US-20230116972-A1 CD38 MODULATORS AND METHODS OF USE THEREOF CYTOKINETICS, INC. 2023-04-20 US disclosed
WO-2023288195-A1 CD38 MODULATORS AND METHODS OF USE THEREOF CYTOKINETICS, INC. (US) 2023-01-19 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-20230116972-A1 CD38 MODULATORS AND METHODS OF USE THEREOF CD38, CXCR4, FCGRT CA1 1153/4885ALDH1A1 358/4885LMNA 1413/4885

“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.