SCHEMBL6679337

SCHEMBL6679337

CCOP(=O)(OCC)Oc1ccc(C=CC(=O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.55
ATM Q13315 1/20 0.55
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
BCHE P06276 1/20 0.49
ACHE P22303 1/20 0.49
SRD5A2 P31213 1/20 0.48
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
POLB P06746 1/20 0.46
MAOB P27338 4/20 0.46
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
MAOA P21397 1/20 0.46
PGR P06401 1/20 0.46

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
SCHEMBL6679336 1.00 THRB (0.55) THRBATMNPC1RAB9AMAPT
SCHEMBL20703838 0.79 KDM4E (0.66) NPC1RAB9AMAPTKMT2ACA1
SCHEMBL20703839 0.79 KDM4E (0.66) NPC1RAB9AMAPTKMT2ACA1
SCHEMBL5026807 0.79 CA2 (0.70) KMT2ACA1CA2BCHEACHE
SCHEMBL556786 0.78 THRB (0.61) THRBATMMAPTKMT2ACA1
SCHEMBL691132 0.78 NPC1 (0.69) THRBATMNPC1RAB9AMAPT
SCHEMBL691131 0.78 NPC1 (0.69) THRBATMNPC1RAB9AMAPT
SCHEMBL31416540 0.78 CA2 (0.57) MAPTKMT2ACA1CA2BCHE
SCHEMBL557324 0.77 CA1 (0.49) KMT2ACA1CA2BCHEACHE
SCHEMBL557323 0.77 CA1 (0.49) KMT2ACA1CA2BCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6828317-B2 Bactericides; gramnegative, grampositive bacteria PHARMACIA & UPJOHN COMPANY 2004-12-07 US disclosed
EP-1472247-A1 ANTIMICROBIAL THIADIAZINONE DERIVATIVES USEFUL IN TREATMENT OF BACTERIAL INFECTIONS PHARMACIA & UPJOHN COMPANY (US) 2004-11-03 EP disclosed
US-20040014746-A1 Antimicrobial thiadiazinone derivatives and their application for treatment of bacterial infections LEUHR GARY W (US) 2004-01-22 US disclosed
WO-2003066631-A1 ANTIMICROBIAL THIADIAZINONE DERIVATIVES USEFUL IN TREATMENT OF BACTERIAL INFECTIONS PHARMACIA & UPJOHN COMPANY (US) 2003-08-14 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-20040014746-A1 Antimicrobial thiadiazinone derivatives and their application for treatment of bacterial infections TBCD, THPO, NISCH THRB 683/4885ATM 2721/4885NPC1 1641/4885

“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.