SCHEMBL14148653

SCHEMBL14148653

O=C(Nc1cccs1)c1sc(-c2ccccc2)nc1-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 5/20 0.61
DBF4 Q9UBU7 5/20 0.61
CCNE1 P24864 1/20 0.53
CDK2 P24941 1/20 0.53
ALDH1A1 P00352 6/20 0.51
KDM4E B2RXH2 3/20 0.51
RXFP1 Q9HBX9 2/20 0.51
PPARG P37231 1/20 0.51
NCOA2 Q15596 1/20 0.51
NCOA1 Q15788 1/20 0.51
MAPT P10636 3/20 0.49
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPSR1 Q6W5P4 4/20 0.47
HPGD P15428 1/20 0.47
GAA P10253 2/20 0.45
HTT P42858 1/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45

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
SCHEMBL14148621 0.82 ALDH1A1 (0.72) CDC7DBF4CCNE1CDK2ALDH1A1
SCHEMBL975727 0.79 CDC7 (0.86) CDC7DBF4CCNE1CDK2ALDH1A1
SCHEMBL14148622 0.79 CDC7 (0.59) CDC7DBF4CCNE1CDK2ALDH1A1
SCHEMBL975863 0.76 CDC7 (0.68) CDC7DBF4CCNE1CDK2ALDH1A1
SCHEMBL16038025 0.76 ALDH1A1 (0.60) CDC7DBF4ALDH1A1KDM4ERXFP1
SCHEMBL978378 0.76 CDC7 (1.00) CDC7DBF4CCNE1CDK2ALDH1A1
SCHEMBL14148633 0.75 CDC7 (0.56) CDC7DBF4CCNE1CDK2ALDH1A1
SCHEMBL27920107 0.75 KDM4E (0.67) CDC7DBF4CCNE1CDK2ALDH1A1
SCHEMBL974859 0.75 CDC7 (0.84) CDC7DBF4CCNE1CDK2ALDH1A1
SCHEMBL14148658 0.74 LMNA (0.76) CDC7DBF4ALDH1A1KDM4EMAPT

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
WO-2008090382-A1 THIAZOLE AND OXAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF PRION DISEASES, CANCER AND CONDITIONS OF THE CENTRAL NERVOUS SYSTEM AS WELL AS IN THE REGULATION OF STEM CELLS THE UNIVERSITY OF SHEFFIELD (GB) 2008-07-31 WO disclosed