SCHEMBL5381803

SCHEMBL5381803

Cc1cc(C)c(Sc2ncn(C(=O)N(C)C)n2)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.38
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
LIPE Q05469 1/20 0.32
MGLL Q99685 2/20 0.30
TRPV1 Q8NER1 1/20 0.30

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
SCHEMBL11376332 0.77 ACHE (0.36) BCHEACHELIPEMGLL
SCHEMBL9260297 0.76 SCN4A (0.40) RORCALDH1A1MAPTBCHEACHE
SCHEMBL9378936 0.72 LMNA (0.36) RORCALDH1A1MAPTBCHEMGLL
SCHEMBL5376972 0.72 ALDH1A1 (0.45) ALDH1A1MAPT
SCHEMBL5371737 0.72 LMNA (0.52) ALDH1A1MAPT
SCHEMBL5378809 0.71 PTPN1 (0.34) ALDH1A1MAPT
SCHEMBL5380304 0.71 ALDH1A1 (0.33) ALDH1A1MAPT
SCHEMBL18179632 0.71 ALDH1A1 (0.34) ALDH1A1MAPTBCHEACHELIPE
SCHEMBL5376756 0.70 ALDH1A1 (0.33) ALDH1A1
SCHEMBL7312272 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7238720-B2 Pharmaceutical use of N-carbamoylazole derivatives EISAI R & D MANAGEMENT CO. LTD. (JP) 2007-07-03 US disclosed
US-7238720-B2 Pharmaceutical use of N-carbamoylazole derivatives EISAI R & D MANAGEMENT CO. LTD. (JP) 2007-07-03 US disclosed
EP-1258480-B1 Pharmaceutical use of N-Carbamoylazole derivatives EISAI CO LTD (JP) 2004-11-10 EP disclosed
EP-1258480-B1 Pharmaceutical use of N-Carbamoylazole derivatives EISAI CO LTD (JP) 2004-11-10 EP disclosed
US-20040186153-A1 Pharmaceutical use of N-carbamoylazole derivatives EISAI R & D MANAGEMENT CO. LTD. (JP) 2004-09-23 US disclosed
US-20030060494-A1 Pharmaceutical use of N-carbamoylazole derivatives EISAI CO., LTD. (JP) 2003-03-27 US disclosed
EP-1258480-A1 Pharmaceutical use of N-Carbamoylazole derivatives Eisai Co., Ltd. (JP) 2002-11-20 EP 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-20040186153-A1 Pharmaceutical use of N-carbamoylazole derivatives DPP4, DPP3, DPP7 RORC 4034/4885ALDH1A1 1026/4885MAPT 3669/4885
US-20030060494-A1 Pharmaceutical use of N-carbamoylazole derivatives DPP4, DPP3, DPP7 RORC 4034/4885ALDH1A1 1026/4885MAPT 3669/4885

“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.