SCHEMBL27480960

SCHEMBL27480960

Nc1cc(Cl)nc(SCC=CC(=O)N2CCCCC2)n1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.52
USP2 O75604 1/20 0.52
ALOX15 P16050 1/20 0.40
ALDH1A1 P00352 5/20 0.38
RAB9A P51151 2/20 0.35
TRPV1 Q8NER1 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD11B1 P28845 1/20 0.34
GAA P10253 1/20 0.34
NPC1 O15118 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL27480959 1.00 HPGD (0.52) HPGDUSP2ALOX15ALDH1A1RAB9A
SCHEMBL8167164 0.99 HPGD (0.50) HPGDUSP2ALOX15ALDH1A1RAB9A
SCHEMBL8167167 0.99 HPGD (0.50) HPGDUSP2ALOX15ALDH1A1RAB9A
SCHEMBL27482110 0.89 PLAU (0.41) HPGDUSP2RAB9AL3MBTL1KMT2A
SCHEMBL27482109 0.89 PLAU (0.41) HPGDUSP2RAB9AL3MBTL1KMT2A
SCHEMBL8133352 0.84 HPGD (0.50) HPGDUSP2ALOX15ALDH1A1RAB9A
SCHEMBL8177970 0.84 HPGD (0.50) HPGDUSP2ALOX15ALDH1A1RAB9A
SCHEMBL8179176 0.83 HPGD (0.48) HPGDUSP2ALOX15ALDH1A1RAB9A
SCHEMBL8179170 0.83 HPGD (0.48) HPGDUSP2ALOX15ALDH1A1RAB9A
SCHEMBL6637452 0.76 TP53 (0.41) HPGDALDH1A1RAB9AL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1535958-A Alpha-substituted pyrimidine. thioalkyl and alkyl ether compound �������Ŷ���Լ��������˾ 2004-10-13 CN disclosed
CN-1152022-C Alpha-substituted pyrimidine-thioalkyl and alkylether compounds �������Ŷ���Լ��������˾ 2004-06-02 CN disclosed
CN-1183773-A Alpha-substituted pyrimidine-thioalkyl and alkylether compounds UPJOHN CO (US) 1998-06-03 CN disclosed