SCHEMBL12464375

SCHEMBL12464375

Cc1nc(-c2ccc(O)cc2)sc1C(=O)NCCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.64
NPC1 O15118 1/20 0.64
SMN1; SMN2 Q16637 4/20 0.60
MAPT P10636 4/20 0.60
ALDH1A1 P00352 2/20 0.60
GAA P10253 2/20 0.60
NPSR1 Q6W5P4 1/20 0.59
PPARA Q07869 1/20 0.56
CHRM4 P08173 2/20 0.54
MAOB P27338 1/20 0.54
SNCA P37840 1/20 0.54
LMNA P02545 3/20 0.54
TP53 P04637 2/20 0.54
THRB P10828 1/20 0.54
SCD O00767 2/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HIF1A Q16665 1/20 0.50

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
SCHEMBL13541937 0.93 HPGD (0.61) HPGDNPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL12464529 0.91 HPGD (0.54) HPGDNPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL12464376 0.88 SCD (0.60) HPGDNPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL12464767 0.88 HPGD (0.67) HPGDNPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL27728329 0.85 PPARA (0.73) NPC1MAPTALDH1A1GAAPPARA
SCHEMBL27624385 0.85 PPARA (0.59) HPGDNPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL12464532 0.85 HPGD (0.52) HPGDNPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL3454120 0.84 MAPT (0.47) HPGDNPC1SMN1; SMN2MAPTPPARA
SCHEMBL28449044 0.81 HPGD (0.76) HPGDNPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL3454883 0.78 NPC1 (0.48) HPGDNPC1SMN1; SMN2MAPTALDH1A1

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 HPGD 710/4885NPC1 225/4885SMN1; SMN2 401/4885

“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.