SCHEMBL6804689

SCHEMBL6804689

O=c1c2ccccc2nc2n1C[C@H](CS)S2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.49
MAPT P10636 4/20 0.49
LMNA P02545 4/20 0.49
KDM4E B2RXH2 8/20 0.45
HPGD P15428 4/20 0.43
ACHE P22303 3/20 0.43
BCHE P06276 2/20 0.43
HSD17B10 Q99714 4/20 0.43
TDP1 Q9NUW8 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
USP2 O75604 1/20 0.43
CYP1A2 P05177 1/20 0.43
CFTR P13569 1/20 0.43
ALOX15 P16050 1/20 0.43
HKDC1 Q2TB90 1/20 0.43
GOPC Q9HD26 1/20 0.43
KMT2A Q03164 4/20 0.42
MEN1 O00255 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL6804691 1.00 ALDH1A1 (0.49) ALDH1A1MAPTLMNAKDM4EHPGD
SCHEMBL6701095 1.00 ALDH1A1 (0.49) ALDH1A1MAPTLMNAKDM4EHPGD
SCHEMBL6703572 0.86 KDM4E (0.54) ALDH1A1MAPTLMNAKDM4EHPGD
SCHEMBL6703570 0.86 KDM4E (0.54) ALDH1A1MAPTLMNAKDM4EHPGD
SCHEMBL6804059 0.82 KMT2A (0.40) LMNAKDM4EHSD17B10CYP1A2KMT2A
SCHEMBL7021046 0.81 PIK3CD (0.39) ALDH1A1LMNAKDM4EHPGDHSD17B10
SCHEMBL7018731 0.81 MAPT (0.51) ALDH1A1MAPTLMNAKDM4EHPGD
SCHEMBL7019524 0.78 RAB9A (0.53) ALDH1A1MAPTLMNAKDM4EHPGD
SCHEMBL7019520 0.78 RAB9A (0.53) ALDH1A1MAPTLMNAKDM4EHPGD
SCHEMBL6801836 0.78 HPGD (0.42) ALDH1A1MAPTKDM4EHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040259192-A1 Method for cleaving the human growth hormone gh IBFB GMBH PRIVATES INSTITUT FUR BIOMEDIZINISCHE FORSCHUNG UND BERATUNG (DE) 2004-12-23 US claimed
WO-2002074945-A1 METHOD FOR CLEAVING HUMAN GROWTH HORMONE GH IBFB GMBH PRIVATES INSTITUT FÜR BIOMEDIZINISCHE FORSCHUNG UND BERATUNG (DE) 2002-09-26 WO claimed
US-20040259192-A1 Method for cleaving the human growth hormone gh IBFB GMBH PRIVATES INSTITUT FUR BIOMEDIZINISCHE FORSCHUNG UND BERATUNG (DE) 2004-12-23 US disclosed
EP-1319010-B1 TRICYCLIC MERCAPTOMETHYL-SUBSTITUTED 2,3-DIHYDRO-QUINAZOLIN-5-ONES AND 2,3-DIHYDRO-BENZO-[1,2,4]-THIADIAZIN-5,5-DIOXIDES AS MATRIX METALLOPROTEINASE (MMP) INHIBITORS IBFB GMBH PRIVATES INST FUER B (DE) 2003-12-17 EP disclosed
WO-2003089416-A1 SUBSTITUTED PYRIMIDINE-2,4(1H,3H)-DIONES FOR USE AS MATRIX METALLOPROTEINASE (MMP) INHIBITORS IBFB GMBH (DE) 2003-10-30 WO disclosed
EP-1357114-A1 Substituted pyrimidin-2,4(1H,3H)-diones as inhibitors of Matrix Metalloproteinases (MMP) IBFB GmbH Privates Institut für biomedizinische Forschung und Beratung (DE) 2003-10-29 EP disclosed
EP-1319010-A1 TRICYCLIC MERCAPTOMETHYL-SUBSTITUTED 2,3-DIHYDRO-QUINAZOLIN-5-ONES AND 2,3-DIHYDRO-BENZO-[1,2,4]-THIADIAZIN-5,5-DIOXIDES AS MATRIX METALLOPROTEINASE (MMP) INHIBITORS IBFB GmbH Privates Institut für biomedizinische Forschung und Beratung (DE) 2003-06-18 EP disclosed
WO-2002074945-A1 METHOD FOR CLEAVING HUMAN GROWTH HORMONE GH IBFB GMBH PRIVATES INSTITUT FÜR BIOMEDIZINISCHE FORSCHUNG UND BERATUNG (DE) 2002-09-26 WO disclosed
WO-2002024710-A1 TRICYCLIC MERCAPTOMETHYL-SUBSTITUTED 2,3-DIHYDRO-QUINAZOLIN-5-ONES AND 2,3-DIHYDRO-BENZO-[1,2,4]-THIADIAZIN-5,5-DIOXIDES AS MATRIX METALLOPROTEINASE (MMP) INHIBITORS IBFB GMBH PRIVATES INSTITUT FÜR BIOMEDIZINISCHE FORSCHUNG UND BERATUNG (DE) 2002-03-28 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-20040259192-A1 Method for cleaving the human growth hormone gh MMP3, MMP25, MMP17 ALDH1A1 3457/4885MAPT 4820/4885LMNA 2308/4885

“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.