SCHEMBL7933290

SCHEMBL7933290

COC(=O)c1sccc1NC(=O)CS

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 5/20 0.66
MAPK10 P53779 5/20 0.66
MAPK9 P45984 3/20 0.66
HTT P42858 1/20 0.64
NPC1 O15118 1/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
HPGD P15428 2/20 0.63
KMT2A Q03164 2/20 0.63
LMNA P02545 2/20 0.63
CASP3 P42574 1/20 0.63
ATM Q13315 1/20 0.63
SENP8 Q96LD8 1/20 0.63
SENP7 Q9BQF6 1/20 0.63
SENP6 Q9GZR1 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
ALDH1A1 P00352 2/20 0.61
MAPK1 P28482 1/20 0.61
MAPT P10636 1/20 0.60
MEN1 O00255 1/20 0.60
CYP1A2 P05177 1/20 0.59

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
SCHEMBL5294918 0.86 MAPK8 (0.68) MAPK8MAPK10MAPK9HTTNPC1
SCHEMBL4749588 0.84 SMN1; SMN2 (0.67) MAPK8MAPK10MAPK9HTTNPC1
SCHEMBL28722481 0.84 MAPK8 (0.66) MAPK8MAPK10MAPK9HTTNPC1
SCHEMBL16760967 0.84 MAPK8 (0.66) MAPK8MAPK10MAPK9HTTNPC1
SCHEMBL5106577 0.83 KMT2A (0.66) MAPK8MAPK10MAPK9HTTNPC1
SCHEMBL4787145 0.82 KMT2A (0.64) MAPK8MAPK10MAPK9HTTNPC1
SCHEMBL4864158 0.81 MAPK8 (0.61) MAPK8MAPK10MAPK9HTTNPC1
SCHEMBL4959294 0.81 ALDH1A1 (0.63) MAPK8MAPK10MAPK9HTTNPC1
SCHEMBL1367369 0.80 NPC1 (0.71) MAPK10NPC1SMN1; SMN2HPGDKMT2A
SCHEMBL1039299 0.80 MAPK8 (1.00) MAPK8MAPK10MAPK9HTTSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110034521-A1 COMPOUNDS AND METHODS FOR TREATING ZINC MATRIX METALLOPROTEASE DEPENDENT DISEASES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-02-10 US disclosed
WO-2010033360-A1 METHODS OF TREATING A BOTULINUM TOXIN RELATED CONDITION IN A SUBJECT 1/3 ABSOLUTE SCIENCE, INC. (US) 2010-03-25 WO disclosed
WO-2009045761-A1 COMPOUNDS AND METHODS FOR TREATING ZINC MATRIX METALLOPROTEASE DEPENDENT DISEASES ABSOLUTE SCIENCE, INC. (US) 2009-04-09 WO 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-20110034521-A1 COMPOUNDS AND METHODS FOR TREATING ZINC MATRIX METALLOPROTEASE DEPENDENT DISEASES MMP7, MMP3, MMP9 MAPK8 4403/4885MAPK10 4133/4885MAPK9 4144/4885

“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.