SCHEMBL12464376

SCHEMBL12464376

Cc1nc(-c2ccc(O)cc2)sc1C(=O)NCCc1ccc(F)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.60
LMNA P02545 4/20 0.57
PPARA Q07869 2/20 0.57
TP53 P04637 5/20 0.56
MAPT P10636 7/20 0.56
NPC1 O15118 3/20 0.52
ALDH1A1 P00352 2/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HPGD P15428 1/20 0.52
THRB P10828 1/20 0.52
GAA P10253 2/20 0.49

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
SCHEMBL13541868 0.88 PPARA (0.69) SCDPPARAMAPTNPC1HPGD
SCHEMBL12464375 0.88 HPGD (0.64) SCDLMNAPPARATP53MAPT
SCHEMBL27624385 0.88 PPARA (0.59) SCDPPARATP53MAPTNPC1
SCHEMBL27728329 0.88 PPARA (0.73) PPARAMAPTNPC1ALDH1A1GAA
SCHEMBL3447237 0.85 SCD (0.56) SCDLMNAPPARATP53MAPT
SCHEMBL13541937 0.82 HPGD (0.61) SCDLMNAPPARATP53MAPT
SCHEMBL3454417 0.81 SCD (0.59) SCDLMNAPPARATP53MAPT
SCHEMBL12464529 0.80 HPGD (0.54) SCDLMNAPPARATP53MAPT
SCHEMBL3455448 0.79 SCD (0.58) SCDLMNAPPARATP53MAPT
SCHEMBL3400908 0.79 PPARA (0.52) LMNAPPARATP53MAPTNPC1

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-20110184027-A1 TISSUE SELECTIVE STEAROYL-COA DESATURASE 1 INHIBITORS AND CELL BASED SCREENING ASSAY FOR THEIR IDENTIFICATION GLENMARK PHARMACEUTICALS S.A. (CH) 2011-07-28 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-20110184027-A1 TISSUE SELECTIVE STEAROYL-COA DESATURASE 1 INHIBITORS AND CELL BASED SCREENING ASSAY FOR THEIR IDENTIFICATION SCD, SCD5, CPT1B SCD 1/4885LMNA 1463/4885PPARA 160/4885

“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.