SCHEMBL27482109

SCHEMBL27482109

Nc1cc(Cl)nc(SC/C=C/C(=O)N2CCOCC2)n1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.41
RAB9A P51151 5/20 0.40
NPC1 O15118 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HPGD P15428 2/20 0.39
USP2 O75604 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ITGB2 P05107 3/20 0.38
ICAM1 P05362 3/20 0.38
ITGAL P20701 3/20 0.38
MAPK1 P28482 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL27482110 1.00 PLAU (0.41) PLAURAB9ANPC1TDP1L3MBTL1
SCHEMBL8167167 0.90 HPGD (0.50) RAB9ANPC1L3MBTL1HPGDUSP2
SCHEMBL8167164 0.90 HPGD (0.50) RAB9ANPC1L3MBTL1HPGDUSP2
SCHEMBL27480960 0.89 HPGD (0.52) RAB9ANPC1L3MBTL1HPGDUSP2
SCHEMBL27480959 0.89 HPGD (0.52) RAB9ANPC1L3MBTL1HPGDUSP2
SCHEMBL8162792 0.85 TP53 (0.41) PLAURAB9ANPC1TDP1L3MBTL1
SCHEMBL8162796 0.85 TP53 (0.41) PLAURAB9ANPC1TDP1L3MBTL1
SCHEMBL8179170 0.74 HPGD (0.48) RAB9ANPC1HPGDUSP2LMNA
SCHEMBL8179176 0.74 HPGD (0.48) RAB9ANPC1HPGDUSP2LMNA
SCHEMBL6637459 0.74 TP53 (0.41) RAB9ANPC1L3MBTL1HPGDMAPK1

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