SCHEMBL1282492

SCHEMBL1282492

CC(C)(C)C(O)(CCCCOc1cccc(Cl)c1)Cn1nc[nH]c1=S

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.38
KDM4E B2RXH2 2/20 0.37
KMT2A Q03164 2/20 0.37
KCNH2 Q12809 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.35

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
SCHEMBL1282821 0.99 HRH3 (0.39) HRH3KDM4EKMT2AKCNH2ALDH1A1
SCHEMBL1282373 0.88 FDPS (0.37) HRH3ALDH1A1SMN1; SMN2
SCHEMBL1282109 0.87 FDPS (0.37) HRH3KDM4E
SCHEMBL1286610 0.84 GAA (0.44) KMT2AALDH1A1LMNAMAPK1HTT
SCHEMBL1281680 0.83 GAA (0.44) KMT2AALDH1A1LMNAMAPK1HTT
SCHEMBL1282998 0.82 L3MBTL1 (0.38) HRH3KMT2AKCNH2ALDH1A1MAPK1
SCHEMBL1283158 0.82 S1PR4 (0.34) ALDH1A1LMNAMAPK1HTT
SCHEMBL1282755 0.81 PPARA (0.34) HRH3KMT2AALDH1A1HTTSMN1; SMN2
SCHEMBL1282504 0.81 L3MBTL1 (0.37) HRH3KMT2AKCNH2ALDH1A1MAPK1
SCHEMBL1282491 0.81 GAA (0.45) KMT2AALDH1A1LMNAMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088660-A1 Antifungal 1,2,4-triazolyl Derivatives BASF SE (DE) 2012-04-12 US 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-20120088660-A1 Antifungal 1,2,4-triazolyl Derivatives ERG28, CYP51A1, DPM1 HRH3 2858/4885KDM4E 1829/4885KMT2A 3034/4885

“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.