SCHEMBL24535362

SCHEMBL24535362

CC(C)(C)CNC(=O)CCNC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.35
ALDH1A1 P00352 2/20 0.32
RECQL P46063 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
CASP2 P42575 1/20 0.31
TSHR P16473 1/20 0.31
TP53BP1 Q12888 2/20 0.30

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
SCHEMBL18272809 0.82 SIGMAR1 (0.49) CACNA1HALDH1A1RECQLSIGMAR1CASP2
SCHEMBL24535555 0.80 SIGMAR1 (0.40) CACNA1HALDH1A1RECQLSIGMAR1CASP2
SCHEMBL19115237 0.80 MAPT (0.45) CACNA1HALDH1A1TSHR
SCHEMBL21579953 0.79 EPHX1 (0.34) TP53BP1
SCHEMBL18738817 0.79 KDM4C (0.46) ALDH1A1CASP2
SCHEMBL14176518 0.79 CASP2 (0.44) ALDH1A1RECQLCASP2TSHRTP53BP1
SCHEMBL20261178 0.78 DPP4 (0.37) CACNA1HRECQL
SCHEMBL8070389 0.78 LDHA (0.34) CACNA1HALDH1A1RECQLCASP2TSHR
SCHEMBL25083240 0.78 CASP2 (0.52) ALDH1A1CASP2
SCHEMBL13853869 0.78 KEAP1 (0.36) CACNA1HALDH1A1RECQLCASP2

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-20230063768-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-03-02 US disclosed
US-20220193242-A1 IMMUNOPHILIN-DEPENDENT INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-06-23 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-20220193242-A1 IMMUNOPHILIN-DEPENDENT INHIBITORS AND USES THEREOF CD74, CD2BP2, SERPINB1 CACNA1H 3067/4885ALDH1A1 3301/4885RECQL 4411/4885
US-20230063768-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF PMP22, MAG, FABP7 CACNA1H 2991/4885ALDH1A1 2795/4885RECQL 3614/4885

“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.