SCHEMBL5076846

SCHEMBL5076846

CCc1nc(C(C)C)sc1NC(=O)C(CC)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.54
MAPT P10636 2/20 0.54
CRHBP P24387 2/20 0.53
CRHR2 Q13324 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 3/20 0.48
KCNQ2 O43526 2/20 0.47
MAPK1 P28482 1/20 0.47
GAA P10253 1/20 0.46
THRB P10828 1/20 0.46
KDM4E B2RXH2 1/20 0.46
USP2 O75604 1/20 0.46
PPARG P37231 1/20 0.46
NCOA2 Q15596 1/20 0.46
HSD17B10 Q99714 1/20 0.46
PDE5A O76074 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
SCHEMBL4956705 0.81 POLB (0.53) POLBMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL6173591 0.71 CDK2 (0.61) POLBMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL31062630 0.70 POLB (0.55) POLBMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL19074542 0.70 ALDH1A1 (0.82) POLBMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL7752354 0.70 ALDH1A1 (0.82) POLBMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL30216520 0.69 POLB (0.54) POLBMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL2753573 0.69 POLB (0.60) POLBMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL30216449 0.69 ALDH1A1 (0.57) POLBMAPTCRHBPCRHR2SMN1; SMN2
SCHEMBL2752637 0.68 POLB (0.73) POLBMAPTPDE5A
SCHEMBL30216440 0.68 KCNQ2 (0.54) POLBMAPTCRHBPCRHR2SMN1; SMN2

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-20080312291-A1 Heterocyclic Gaba-b Modulators ASTRAZENECA AB (SE) 2008-12-18 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-20080312291-A1 Heterocyclic Gaba-b Modulators GABBR1, GABBR2, GABRB1 POLB 3748/4885MAPT 3842/4885CRHBP 1352/4885

“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.