SCHEMBL14136972

SCHEMBL14136972

O=C(NC(=S)Nc1cccc(OCc2ccccc2)c1)C1Cc2cc(Cl)ccc2O1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.49
KMT2A Q03164 7/20 0.49
RAB9A P51151 1/20 0.49
ALOX12 P18054 2/20 0.44
TP53 P04637 1/20 0.44
GAA P10253 1/20 0.44
LMNA P02545 2/20 0.44
HTT P42858 2/20 0.44
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
POLB P06746 2/20 0.43
F10 P00742 3/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
GLS O94925 1/20 0.42
PPIA P62937 1/20 0.41
MAPT P10636 2/20 0.41
PTPN7 P35236 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
SCHEMBL4375332 0.90 MEN1 (0.53) MEN1KMT2ARAB9ALMNAHTT
SCHEMBL4363918 0.85 MEN1 (0.52) MEN1KMT2ARAB9ALMNAHTT
SCHEMBL4366796 0.81 NPC1 (0.58) MEN1KMT2ARAB9AHTTSMN1; SMN2
SCHEMBL4363934 0.81 NPC1 (0.58) MEN1KMT2ARAB9AHTTSMN1; SMN2
SCHEMBL14136894 0.81 MEN1 (0.49) MEN1KMT2ARAB9AALOX12GAA
SCHEMBL14136971 0.80 MEN1 (0.54) MEN1KMT2ARAB9AALOX12GAA
SCHEMBL3635094 0.75 MEN1 (0.54) MEN1KMT2ARAB9ALMNAHTT
SCHEMBL14096204 0.73 F10 (0.59) MEN1KMT2ARAB9ALMNAHTT
SCHEMBL14136859 0.73 MEN1 (0.52) MEN1KMT2ARAB9AALOX12LMNA
SCHEMBL14096101 0.73 MEN1 (0.57) MEN1KMT2ARAB9AALOX12TP53

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-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv ACHILLION PHARMACEUTICALS, INC. (US) 2008-08-28 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-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv RNASE1, SARS1, EIF2AK2 MEN1 4577/4885KMT2A 4579/4885RAB9A 3144/4885

“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.