SCHEMBL22713022

SCHEMBL22713022

C=CC(=O)Oc1cnn(C2CC2)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.39
▸ JAK3 P52333 11/20 0.35
▸ BTK Q06187 11/20 0.35
▸ KDM4C Q9H3R0 3/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ KDM4A O75164 1/20 0.34
▸ KDM5C P41229 1/20 0.34
▸ KDM4D Q6B0I6 1/20 0.34
▸ THRB P10828 1/20 0.33
▸ EGFR P00533 1/20 0.33

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
SCHEMBL22713064 0.78 KDM5B (0.36) ACHE
SCHEMBL27550332 0.77 THRB (0.40) JAK3BTKKDM4CTHRB
SCHEMBL11001892 0.74 ACHE (0.48) ACHEJAK3BTKKDM4CKDM4E
SCHEMBL27074350 0.73 CYP1A2 (0.49) KDM4E
SCHEMBL27965773 0.72 CHRNB2 (0.43) —
SCHEMBL25477789 0.71 LOXL2 (0.39) ACHEKDM4CKDM4EKDM4AKDM5C
SCHEMBL28925341 0.70 ACHE (0.44) ACHEJAK3BTKKDM4CTHRB
SCHEMBL21050072 0.70 KMT2A (0.44) ACHE
SCHEMBL24686656 0.67 EIF2AK4 (0.39) ACHEKDM4CKDM4EKDM4AKDM5C
SCHEMBL3295288 0.66 ACHE (0.57) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210198235-A1 DERIVATIVES OF PIPERLONGUMINE AND USES THEREOF AURANSA INC. 2021-07-01 — — US disclosed
US-20200377510-A1 DERIVATIVES OF PIPERLONGUMINE AND USES THEREOF AURANSA INC. 2020-12-03 — — 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 (2 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-20200377510-A1 DERIVATIVES OF PIPERLONGUMINE AND USES THEREOF SHARPIN, PIR, THPO ACHE 2103/4885JAK3 981/4885BTK 2463/4885
US-20210198235-A1 DERIVATIVES OF PIPERLONGUMINE AND USES THEREOF THPO, PIR, PAK6 ACHE 3505/4885JAK3 2517/4885BTK 4298/4885

“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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