SCHEMBL3679900

SCHEMBL3679900

Cc1ccc(C)c(CC(=O)N2CCN(C(N)=S)CC2)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
TSHR P16473 1/20 0.47
MAPT P10636 4/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 2/20 0.46
POLB P06746 5/20 0.43
ALDH1A1 P00352 2/20 0.42
TP53 P04637 2/20 0.42
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL3683326 0.84 ALDH1A1 (0.46) MEN1KMT2ATSHRMAPTLMNA
SCHEMBL22800924 0.84 MEN1 (0.50) MEN1KMT2ATSHRMAPTLMNA
SCHEMBL10924343 0.80 HTT (0.47) MEN1KMT2AMAPTLMNAHTT
SCHEMBL22800944 0.80 POLB (0.48) MEN1KMT2ATSHRMAPTLMNA
SCHEMBL30791191 0.78 MAPT (0.66) MEN1KMT2ATSHRMAPTLMNA
SCHEMBL22800927 0.77 KMT2A (0.48) MEN1KMT2ATSHRMAPTLMNA
SCHEMBL30262209 0.77 KMT2A (0.48) MEN1KMT2ATSHRMAPTLMNA
SCHEMBL2581184 0.77 L3MBTL1 (0.56) MEN1KMT2ATSHRMAPTLMNA
SCHEMBL3686275 0.75 ALDH1A1 (0.41) MEN1KMT2ATSHRMAPTLMNA
SCHEMBL2586245 0.74 ALDH1A1 (0.69) MEN1KMT2AMAPTHTTPOLB

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 MEN1 2411/4885KMT2A 2074/4885TSHR 2769/4885

“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.