SCHEMBL22402385

SCHEMBL22402385

CC(C)n1ccc2ccc(C(C)(C)C)nc21

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL18806211 0.77 HCAR3 (0.33) KDM4ENPC1RAB9A
SCHEMBL15469665 0.76 DDB1 (0.37) KDM4EMAPTL3MBTL1
SCHEMBL21285447 0.76 PDE2A (0.31) KDM4E
SCHEMBL16884032 0.76 CCR1 (0.38) KDM4ERAB9A
SCHEMBL24334808 0.74 CCNA2 (0.31)
SCHEMBL21419219 0.74 L3MBTL1 (0.33) L3MBTL1
SCHEMBL26631389 0.74 CCNE2 (0.30)
SCHEMBL18125590 0.74 L3MBTL1 (0.30) L3MBTL1
SCHEMBL14199825 0.73 DRD2 (0.32)
SCHEMBL24334818 0.70 JAK2 (0.32)

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-20220024901-A1 GLP-1R AGONISTS AND USES THEREOF QILU REGOR THERAPEUTICS INC. (CN) 2022-01-27 US disclosed
US-20200283424-A1 GLP-1R AGONISTS AND USES THEREOF QILU REGOR THERAPEUTICS INC. (CN) 2020-09-10 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-20200283424-A1 GLP-1R AGONISTS AND USES THEREOF GLP1R, GPR119, GIPR KDM4E 2708/4885NPC1 706/4885MAPT 3725/4885
US-20220024901-A1 GLP-1R AGONISTS AND USES THEREOF GLP1R, GPR119, GIPR KDM4E 3296/4885NPC1 609/4885MAPT 3678/4885

“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.