SCHEMBL950351

SCHEMBL950351

CSCCCc1nccn1C

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
LPO P22079 1/20 0.36
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
CNR2 P34972 1/20 0.35
DRD4 P21917 1/20 0.34
TSHR P16473 1/20 0.32
OPRK1 P41145 1/20 0.32
TRPM5 Q9NZQ8 1/20 0.31
HTT P42858 1/20 0.31
MAPK13 O15264 1/20 0.31
MAPK12 P53778 1/20 0.31
MAPK11 Q15759 1/20 0.31
MAPK14 Q16539 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL950780 0.89 FDPS (0.41) FDPSKMT2AMEN1LPOFNTA
SCHEMBL27698626 0.87 FDPS (0.40) FDPSKMT2AMEN1LPOFNTA
SCHEMBL7166348 0.84 FDPS (0.46) FDPSKMT2AMEN1LPOFNTA
SCHEMBL2398203 0.84 FDPS (0.46) FDPSKMT2AMEN1LPOFNTA
SCHEMBL20747217 0.84 FDPS (0.38) FDPSKMT2AMEN1LPOFNTA
SCHEMBL7152443 0.82 FDPS (0.44) FDPSKMT2AMEN1LPOFNTA
Water SCHEMBL29120398 0.82 FDPS (0.44) FDPSKMT2AMEN1LPOFNTA
SCHEMBL2399728 0.82 FDPS (0.44) FDPSKMT2AMEN1LPOFNTA
SCHEMBL2393253 0.82 FDPS (0.44) FDPSKMT2AMEN1LPOFNTA
SCHEMBL2395476 0.82 FDPS (0.44) FDPSKMT2AMEN1LPOFNTA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190031658-A1 BENZAMIDE AND NICOTINAMIDE COMPOUNDS AND METHODS OF USING SAME ONCOTARTIS INC. 2019-01-31 US disclosed
US-20110021483-A1 Platinum (IV) Complexes PLATCO TECHNOLOGIES (PROPRIETARY) LIMITED (ZA) 2011-01-27 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 (2 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-20110021483-A1 Platinum (IV) Complexes OTC, OAT, SLC25A11 FDPS 2194/4885KMT2A 3593/4885MEN1 974/4885
US-20190031658-A1 BENZAMIDE AND NICOTINAMIDE COMPOUNDS AND METHODS OF USING SAME NNT, NAMPT, NNMT FDPS 950/4885KMT2A 275/4885MEN1 694/4885

“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.