SCHEMBL13467800

SCHEMBL13467800

CCSc1nc2ccsc2c(=O)n1CC

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.80
▸ PDE7A Q13946 10/20 0.59
▸ LMNA P02545 5/20 0.57
▸ ALDH1A1 P00352 3/20 0.57
▸ HPGD P15428 1/20 0.57
▸ PDE4B Q07343 5/20 0.56
▸ PDE7B Q9NP56 1/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ RXFP1 Q9HBX9 1/20 0.55
▸ MAPT P10636 1/20 0.54
▸ THRB P10828 1/20 0.52
▸ PKM P14618 1/20 0.51
▸ HTT P42858 1/20 0.51

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
SCHEMBL13451645 0.87 L3MBTL1 (0.73) L3MBTL1PDE7ALMNAALDH1A1HPGD
SCHEMBL7891889 0.76 L3MBTL1 (0.62) L3MBTL1PDE7ALMNAALDH1A1PDE4B
SCHEMBL18997470 0.75 L3MBTL1 (0.62) L3MBTL1PDE7ALMNAALDH1A1HPGD
SCHEMBL10175968 0.75 RECQL (0.75) L3MBTL1LMNAALDH1A1HPGDSMN1; SMN2
SCHEMBL5477516 0.72 ALDH1A1 (0.50) L3MBTL1PDE7ALMNAALDH1A1SMN1; SMN2
SCHEMBL12713425 0.69 LMNA (0.78) L3MBTL1LMNAALDH1A1HPGDSMN1; SMN2
SCHEMBL11046960 0.69 ALDH1A1 (0.54) L3MBTL1PDE7ALMNAALDH1A1PDE4B
SCHEMBL20152123 0.69 ALDH1A1 (0.64) L3MBTL1PDE7ALMNAALDH1A1PDE4B
SCHEMBL5437926 0.68 SMN1; SMN2 (0.67) L3MBTL1LMNAALDH1A1HPGDSMN1; SMN2
SCHEMBL12713388 0.68 LMNA (0.63) L3MBTL1PDE7ALMNAALDH1A1SMN1; 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-20120264760-A1 Compounds and Methods for Treating Mammalian Gastrointestinal Parasitic Infections UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2012-10-18 — — US disclosed
US-20100022547-A1 Compounds and Methods for Treating Mammalian Gastrointestinal Parasitic Infections BRANDEIS UNIVERSITY (US) 2010-01-28 — — 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-20120264760-A1 Compounds and Methods for Treating Mammalian Gastrointestinal Parasitic Infections IMPDH1, IMPDH2, ITPA L3MBTL1 2751/4885PDE7A 86/4885LMNA 3931/4885
US-20100022547-A1 Compounds and Methods for Treating Mammalian Gastrointestinal Parasitic Infections IMPDH1, IMPDH2, ITPA L3MBTL1 2751/4885PDE7A 86/4885LMNA 3931/4885

“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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