SCHEMBL23638642

SCHEMBL23638642

CCC(C)(C)c1nnc2n1CCC2

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
ALDH1A1 P00352 5/20 0.38
TSHR P16473 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.35
HSD11B1 P28845 2/20 0.34
HSD11B2 P80365 1/20 0.34
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL23638561 0.86 POLB (0.40) POLBALDH1A1TSHRCYP1A2CYP2C19
SCHEMBL15979338 0.86 POLB (0.42) POLBALDH1A1TSHRCYP1A2CYP2C19
SCHEMBL23638633 0.83 HSD11B1 (0.39) POLBALDH1A1TSHRCYP1A2CYP2C19
SCHEMBL14030258 0.81 POLB (0.47) POLBALDH1A1TSHRCYP1A2CYP2C19
SCHEMBL23638716 0.78 POLB (0.44) POLBALDH1A1TSHRCYP1A2CYP2C19
SCHEMBL23638522 0.76 DPP4 (0.30)
SCHEMBL14030286 0.76 POLB (0.55) POLBALDH1A1TSHRCYP1A2CYP2C19
SCHEMBL14030255 0.74 POLB (0.58) POLBALDH1A1TSHRCYP1A2CYP2C19
SCHEMBL14030375 0.74 POLB (0.58) POLBALDH1A1TSHRCYP1A2CYP2C19
SCHEMBL4536746 0.71 POLB (0.50) POLBALDH1A1HPGDHSD11B1HSD11B2

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-20210213006-A1 METHODS OF TREATING NEURODEGENERATIVE DISEASES Seal Rock Therapeutics, Inc. 2021-07-15 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-20210213006-A1 METHODS OF TREATING NEURODEGENERATIVE DISEASES SNCA, MAPT, HTT POLB 2382/4885ALDH1A1 2222/4885TSHR 3759/4885

“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.