SCHEMBL7488237

SCHEMBL7488237

O=C1CCCc2c1sc1nncn21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 11/20 0.36
PARP2 Q9UGN5 11/20 0.36
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
PARP15 Q460N3 10/20 0.34
PARP10 Q53GL7 8/20 0.34
PTGS2 P35354 2/20 0.34
ELANE P08246 1/20 0.34
PTGS1 P23219 1/20 0.34
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PARP14 Q460N5 2/20 0.33
BRPF1 P55201 1/20 0.33
TNKS O95271 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
Bromide SCHEMBL7483044 0.98 TNKS2 (0.35) TNKS2PARP2MEN1CYP1A2POLB
Bromide SCHEMBL7483053 0.73 POLB (0.39) TNKS2PARP2MEN1CYP1A2POLB
SCHEMBL20518804 0.70 ALDH1A1 (0.35) MEN1POLBKMT2AELANEALDH1A1
SCHEMBL7479395 0.67 SMN1; SMN2 (0.62) MEN1POLBKMT2AALDH1A1KDM4E
Bromide SCHEMBL7479450 0.66 SMN1; SMN2 (0.64) MEN1POLBKMT2AALDH1A1KDM4E
SCHEMBL7477728 0.66 KDM4E (0.40) TNKS2PARP2POLBKMT2APARP15
SCHEMBL7487088 0.63 SMN1; SMN2 (0.46) MEN1POLBKMT2AALDH1A1MAPK1
SCHEMBL4014392 0.54 TNKS2 (0.44) TNKS2PARP2KMT2APARP15PARP10
SCHEMBL19028806 0.54 PDPK1 (0.47) HSD17B10PLK1CSNK2A1PLK3
SCHEMBL31696695 0.53 PLK1 (0.44) MEN1KMT2AELANEALDH1A1KDM4E

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
EP-0843681-B1 HETEROCYCLE-FUSED THIAZOLE DERIVATIVES YUNGJIN PHARMACEUTICAL CO LTD (KR) 2002-03-06 EP disclosed