SCHEMBL25895296

SCHEMBL25895296

CC(C)CN1CCC2(CCN(C(C)C)C2=O)C1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 13/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PIK3CD O00329 4/20 0.37
AOC2 O75106 1/20 0.36
CYP3A4 P08684 9/20 0.35
USP2 O75604 4/20 0.35
CYP1A2 P05177 4/20 0.35
TSHR P16473 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 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
SCHEMBL25959053 0.92 PIK3CD (0.38) CYP2D6SMN1; SMN2PIK3CDAOC2USP2
SCHEMBL3422977 0.78 PIK3CD (0.47) CYP2D6SMN1; SMN2PIK3CDCYP3A4USP2
SCHEMBL22156260 0.76 CHRM2 (0.38) AOC2
SCHEMBL12758823 0.76 OPRM1 (0.34) CYP2D6SMN1; SMN2AOC2
SCHEMBL12832224 0.74 CHRM2 (0.35) CYP2D6AOC2
SCHEMBL12758825 0.74 SMN1; SMN2 (0.36) CYP2D6SMN1; SMN2AOC2
SCHEMBL24338550 0.74 GRIN2B (0.44) CYP2D6CYP3A4USP2CYP1A2TSHR
SCHEMBL25664906 0.73 PIK3CD (0.46) CYP2D6SMN1; SMN2PIK3CDUSP2CYP1A2
SCHEMBL13431755 0.73 PRMT1 (0.37) AOC2ALDH1A1
SCHEMBL14684737 0.73 AOC2 (0.34) AOC2CYP1A2

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
US-11739074-B2 Ras inhibitors Revolution Medicines, Inc. (US) 2023-08-29 US disclosed
US-20230233569-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2023-07-27 US disclosed
US-20230233569-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 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 (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-11739074-B2 Ras inhibitors KRAS, NRAS, HRAS CYP2D6 2362/4885SMN1; SMN2 3861/4885PIK3CD 180/4885
US-20230233569-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS KRAS, HRAS, MTOR CYP2D6 4714/4885SMN1; SMN2 1139/4885PIK3CD 215/4885

“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.