SCHEMBL4715877

SCHEMBL4715877

O=C1NC(=Nc2cccc(Cl)c2Cl)SC1Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
MEN1 O00255 5/20 0.50
MAPT P10636 3/20 0.50
HTT P42858 3/20 0.50
LMNA P02545 3/20 0.50
MAPK1 P28482 2/20 0.50
ALDH1A1 P00352 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.45
RAB9A P51151 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GLA P06280 1/20 0.41
PPARG P37231 1/20 0.40
HSD11B1 P28845 1/20 0.40
FFAR1 O14842 1/20 0.39

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
SCHEMBL4136931 0.87 KMT2A (0.47) KMT2AMEN1MAPTHTTLMNA
SCHEMBL4136928 0.87 KMT2A (0.47) KMT2AMEN1MAPTHTTLMNA
SCHEMBL4140178 0.84 KMT2A (0.52) KMT2AMEN1MAPTHTTLMNA
SCHEMBL4140176 0.84 KMT2A (0.52) KMT2AMEN1MAPTHTTLMNA
SCHEMBL4128887 0.83 LMNA (0.59) KMT2AMEN1MAPTHTTLMNA
SCHEMBL4128884 0.83 LMNA (0.59) KMT2AMEN1MAPTHTTLMNA
SCHEMBL4145485 0.82 KMT2A (0.71) KMT2AMEN1MAPTHTTLMNA
SCHEMBL4145482 0.82 KMT2A (0.71) KMT2AMEN1MAPTHTTLMNA
SCHEMBL4136140 0.80 KMT2A (0.58) KMT2AMEN1MAPTHTTLMNA
SCHEMBL4136143 0.80 KMT2A (0.58) KMT2AMEN1MAPTHTTLMNA

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
EP-1906955-A2 USE OF THIAZOLE DERIVATIVES AND ANALOGUES IN THE TREATMENT OF CANCER Betagenon AB (SE) 2008-04-09 EP disclosed
WO-2007010273-A2 USE OF THIAZOLE DERIVATIVES AND ANALOGUES IN THE TREATMENT OF CANCER BETAGENON AB (SE) 2007-01-25 WO disclosed