SCHEMBL24209554

SCHEMBL24209554

NCc1ccc(C2(C(F)(F)F)NN2)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 7/20 0.41
HRH3 Q9Y5N1 1/20 0.39
ABAT P80404 1/20 0.37
MAOB P27338 3/20 0.35
TAAR1 Q96RJ0 2/20 0.34
F10 P00742 1/20 0.32
F11 P03951 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
ST14 Q9Y5Y6 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
SCHEMBL2522385 0.82 PNMT (0.40) LOXL2MAOBTAAR1
SCHEMBL13573443 0.80 PDK2 (0.37) CA12CA1CA2CA4CA6
SCHEMBL17625640 0.78 TSHR (0.37)
SCHEMBL17625650 0.76 CES1 (0.35) CA2
SCHEMBL17625646 0.76 CA1 (0.31) CA1CA2
SCHEMBL17625661 0.74 PTPRZ1 (0.49) MAOB
SCHEMBL14216867 0.72 MAOB (0.38) MAOBCA1CA2CA5ACA9
SCHEMBL5356087 0.72 ESR1 (0.38) CA12CA1CA2CA4CA5A
SCHEMBL993942 0.72 KIF11 (0.45) LOXL2HRH3ABATMAOBTAAR1
SCHEMBL24196140 0.72 LOXL2 (0.41) LOXL2HRH3ABATMAOBTAAR1

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
WO-2023215514-A2 BIOLUMINESCENCE-TRIGGERED PHOTOCATALYTIC LABELING PROMEGA CORPORATION (US) 2023-11-09 WO disclosed
CN-115108988-A Synthesis and use of polyfunctional diaziridines binders for elastomer bonding 元平台技术有限公司 2022-09-27 CN disclosed
US-20220017471-A1 FUNCTIONALITY INDEPENDENT LABELING OF ORGANIC COMPOUNDS UNIV SHANGHAI TECHNOLOGY (CN) 2022-01-20 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-20220017471-A1 FUNCTIONALITY INDEPENDENT LABELING OF ORGANIC COMPOUNDS PAICS, PFAS, OTC LOXL2 641/4885HRH3 3787/4885ABAT 70/4885

“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.