SCHEMBL3686471

SCHEMBL3686471

N#Cc1ccccc1C1CC(c2csc(C3CCNCC3)n2)=NO1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FAAH O00519 19/20 0.50
HPGDS O60760 1/20 0.43

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
Hydrochloric Acid SCHEMBL30585 0.84 FAAH (0.48) FAAHHPGDS
Hydrochloric Acid SCHEMBL192765 0.84 FAAH (0.46) FAAHHPGDS
SCHEMBL193198 0.82 FAAH (0.63) FAAH
Hydrochloric Acid SCHEMBL30164 0.81 FAAH (0.47) FAAHHPGDS
Hydrochloric Acid SCHEMBL30593 0.81 FAAH (0.47) FAAHHPGDS
Hydrochloric Acid SCHEMBL3690942 0.81 FAAH (0.62) FAAH
Hydrochloric Acid SCHEMBL2006375 0.80 FAAH (0.45) FAAHHPGDS
Hydrochloric Acid SCHEMBL29406 0.80 FAAH (0.50) FAAH
SCHEMBL30178150 0.79 FAAH (0.46) FAAHHPGDS
Hydrochloric Acid SCHEMBL16539698 0.79 FAAH (0.46) FAAHHPGDS

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-8449898-B2 Fungicidal mixtures E I DU PONT DE NEMOURS AND COMPANY (US) 2013-05-28 US disclosed
US-20100240619-A1 FUNGICIDAL MIXTURES CORTEVA AGRISCIENCE LLC 2010-09-23 US disclosed
EP-2187748-A2 FUNGICIDAL COMPOUNDS AND MIXTURES E. I. du Pont de Nemours and Company (US) 2010-05-26 EP disclosed
WO-2009055514-A2 FUNGICIDAL MIXTURES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2009-04-30 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-20100240619-A1 FUNGICIDAL MIXTURES CYP1B1, CYP1A1, NOX1 FAAH 1099/4885HPGDS 4132/4885

“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.