SCHEMBL19079883

SCHEMBL19079883

CC(=O)CSc1nc2sccc2c(=O)n1C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 2/20 0.52
▸ POLB P06746 4/20 0.50
▸ PDE4D Q08499 1/20 0.49
▸ KMT2A Q03164 4/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ SLC22A12 Q96S37 1/20 0.44
▸ LMNA P02545 2/20 0.44
▸ HPGD P15428 1/20 0.43
▸ TGM2 P21980 1/20 0.43

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
SCHEMBL19079880 0.78 USP2 (0.82) USP2POLBKMT2ASMN1; SMN2MEN1
SCHEMBL13180853 0.70 LMNA (0.70) POLBKMT2AMEN1ALDH1A1MAPK1
SCHEMBL7495037 0.68 LMNA (0.48) POLBPDE4DKMT2ASMN1; SMN2MEN1
SCHEMBL24029049 0.67 POLB (0.66) POLBPDE4DKMT2AMEN1ALDH1A1
SCHEMBL19079673 0.67 HTT (0.58) POLBKMT2AMEN1ALDH1A1TSHR
SCHEMBL19079691 0.66 PDE4D (1.00) POLBPDE4DSMN1; SMN2ALDH1A1TSHR
SCHEMBL15503867 0.66 USP2 (0.78) USP2POLBKMT2ASMN1; SMN2MEN1
SCHEMBL19079694 0.66 PDE4D (0.76) USP2POLBPDE4DSMN1; SMN2ALDH1A1
SCHEMBL9725963 0.65 ALDH1A1 (0.67) USP2POLBKMT2AMEN1ALDH1A1
SCHEMBL19079793 0.65 ALDH1A1 (0.78) USP2POLBPDE4DKMT2ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170190717-A1 Compounds and Methods for Inhibition of Hedgehog Signaling and Phosphodiesterase VANDERBILT UNIVERSITY 2017-07-06 — — US disclosed
US-20170190717-A1 Compounds and Methods for Inhibition of Hedgehog Signaling and Phosphodiesterase VANDERBILT UNIVERSITY 2017-07-06 — — 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-20170190717-A1 Compounds and Methods for Inhibition of Hedgehog Signaling and Phosphodiesterase PDE4A, PDE4B, PDE7A USP2 758/4885POLB 2192/4885PDE4D 6/4885

“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.

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