SCHEMBL26501618

SCHEMBL26501618

Cc1ncc(N2CCN(C(=O)Cc3ccc(C(C)C)cc3)CC2)cn1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PANK3 Q9H999 9/20 0.76
GFER P55789 2/20 0.50
POLB P06746 2/20 0.50
ATM Q13315 1/20 0.50
ME2 P23368 2/20 0.49
ME1 P48163 2/20 0.49
ME3 Q16798 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
KDM4E B2RXH2 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 2/20 0.47
HTT P42858 2/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
ALOX12 P18054 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL26502420 0.88 PANK3 (0.69) PANK3GFERPOLBATMME2
SCHEMBL21423676 0.86 PANK3 (1.00) PANK3GFERPOLBATMME2
SCHEMBL26501643 0.82 PANK3 (0.81) PANK3ME2ME1ME3SMN1; SMN2
SCHEMBL21406475 0.81 PANK3 (0.63) PANK3POLBME2ME1ME3
SCHEMBL26501471 0.81 PANK3 (0.73) PANK3ME2ME1ME3SMN1; SMN2
SCHEMBL19748346 0.79 PANK3 (1.00) PANK3ME2ME1ME3SMN1; SMN2
SCHEMBL26502429 0.78 PANK3 (0.59) PANK3SMN1; SMN2KDM4EALDH1A1HTT
SCHEMBL26501627 0.78 PANK3 (0.76) PANK3SMN1; SMN2ALDH1A1MAPTMAPK1
SCHEMBL21423846 0.78 PANK3 (0.72) PANK3ME2ME1ME3SMN1; SMN2
SCHEMBL26501625 0.78 PANK3 (0.80) PANK3POLBSMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. 2023-10-12 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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR HMGCR, GCDH, CYP11A1 PANK3 1573/4885GFER 676/4885POLB 1599/4885

“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.