SCHEMBL24424912

SCHEMBL24424912

NCc1ncc(C(F)(F)F)[nH]1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.40
LOXL2 Q9Y4K0 2/20 0.35
LOX P28300 1/20 0.35
DGAT1 O75907 4/20 0.32
HRH1 P35367 1/20 0.31
HRH4 Q9H3N8 1/20 0.31

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
Hydrochloric Acid SCHEMBL14744363 0.84 CACNA1H (0.40) CACNA1HHRH1HRH4
SCHEMBL19116691 0.79 DGAT1 (0.35) DGAT1
SCHEMBL31373920 0.76 TSHR (0.37) DGAT1
SCHEMBL14744470 0.76 MAOB (0.38) DGAT1
SCHEMBL18255655 0.75 PKM (0.38) DGAT1
SCHEMBL13750280 0.72
SCHEMBL19443031 0.72 DGAT1 (0.32) DGAT1HRH4
SCHEMBL20589156 0.71 MASP2 (0.38) DGAT1
Hydrochloric Acid SCHEMBL22188751 0.71 MASP2 (0.38) DGAT1
SCHEMBL15244818 0.70 SCN2A (0.44) CACNA1HHRH1HRH4

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-116635380-A PPARgamma modulators and methods of use 卫材R&D管理有限公司 2023-08-22 CN disclosed
US-20230062861-A1 PPARg MODULATORS AND METHODS OF USE EISAI R&D MANAGEMENT CO., LTD. (JP) 2023-03-02 US disclosed
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 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-20230062861-A1 PPARg MODULATORS AND METHODS OF USE PPARG, PPARA, PPARD CACNA1H 3436/4885LOXL2 3780/4885LOX 3981/4885

“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.