SCHEMBL6638320

SCHEMBL6638320

Nc1cc(Cl)nc(SCc2ccc3ncccc3c2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
DYRK1A Q13627 1/20 0.45
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
HSP90AA1 P07900 1/20 0.43
HSP90AB1 P08238 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
CASP1 P29466 1/20 0.43
HTT P42858 1/20 0.43
ATM Q13315 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
MET P08581 5/20 0.41

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
SCHEMBL6641213 0.90 MEN1 (0.51) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL8126631 0.83 RAB9A (0.46) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL6639242 0.83 MEN1 (0.57) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL6644471 0.78 KMT2A (0.43) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL6642168 0.77 MEN1 (0.60) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL489860 0.77 RAB9A (0.78) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL6638041 0.76 RAB9A (0.55) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL6642311 0.76 ALDH1A1 (0.46) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL490003 0.76 MEN1 (0.59) MEN1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL6642034 0.75 MEN1 (0.55) MEN1KMT2ARAB9ANPC1SMN1; SMN2

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 4 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
EP-1449835-A2 Alpha-substituted pyrimidine-thioalkyl and alkylether compounds PHARMACIA & UPJOHN COMPANY (US) 2004-08-25 EP disclosed
CN-1152022-C Alpha-substituted pyrimidine-thioalkyl and alkylether compounds �������Ŷ���Լ��������˾ 2004-06-02 CN disclosed
EP-1247804-A1 Pyrimidine-thioalkyl and alkylether compounds PHARMACIA & UPJOHN COMPANY (US) 2002-10-09 EP disclosed