SCHEMBL25904153

SCHEMBL25904153

CC(C)(C)C(=O)N1CCC(CN2CCC3(CCC(C(C)(C)C)CC3)CC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.48
CYP2D6 P10635 2/20 0.45
CYP1A2 P05177 1/20 0.45
CXCR3 P49682 1/20 0.42
OPRL1 P41146 1/20 0.38
HSD11B1 P28845 1/20 0.35
KCNH2 Q12809 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
CNR2 P34972 1/20 0.33
HTR4 Q13639 1/20 0.33
ITGB3 P05106 1/20 0.33
ITGA2B P08514 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
MAPT P10636 2/20 0.33
EPHX2 P34913 1/20 0.33
CYP3A4 P08684 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
SCHEMBL25924571 0.88 CXCR3 (0.43) ALOX15CXCR3CNR2HTR4ITGB3
SCHEMBL26138785 0.86 CXCR3 (0.49) CYP2D6CXCR3HSD11B1KCNH2HRH3
SCHEMBL29317714 0.84 CYP2D6 (0.44) ALOX15CYP2D6CYP1A2HSD11B1KCNH2
SCHEMBL25916783 0.84 ALOX15 (0.48) ALOX15CYP2D6CYP1A2OPRL1HSD11B1
SCHEMBL29317721 0.76 EPHX2 (0.36) ALOX15CYP2D6CYP1A2HSD11B1KCNH2
SCHEMBL29317718 0.76 HSD11B1 (0.43) ALOX15CYP2D6CYP1A2OPRL1HSD11B1
SCHEMBL20469326 0.75 CXCR3 (0.45) CXCR3HSD11B1HRH3CNR2
SCHEMBL25133378 0.75 CXCR3 (0.46) CXCR3CNR2HTR4ITGB3ITGA2B
SCHEMBL25597176 0.75 CXCR3 (0.46) CXCR3CNR2HTR4MAPT
SCHEMBL12776577 0.74 KCNH2 (0.53) CYP2D6HSD11B1KCNH2HRH3EPHX2

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-20230234936-A1 COMPOUND FOR TARGETING AND DEGRADING PROTEIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF LEADINGTAC PHARMACEUTICAL (SHAOXING) CO., LTD. (CN) 2023-07-27 US disclosed
US-20230234936-A1 COMPOUND FOR TARGETING AND DEGRADING PROTEIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF LEADINGTAC PHARMACEUTICAL (SHAOXING) CO., LTD. (CN) 2023-07-27 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-20230234936-A1 COMPOUND FOR TARGETING AND DEGRADING PROTEIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF IRAK4, IRAK2, IRAK1 ALOX15 2547/4885CYP2D6 2818/4885CYP1A2 4370/4885

“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.