SCHEMBL3715482

SCHEMBL3715482

O=C(O)c1sc(Br)cc1NC(=O)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN5 P54829 1/20 0.38
PTPN1 P18031 10/20 0.38
PTPRF P10586 2/20 0.37
CA2 P00918 1/20 0.36
PTPRA P18433 1/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
CRHBP P24387 1/20 0.35
KMT2A Q03164 1/20 0.35
CRHR2 Q13324 1/20 0.35
GSK3B P49841 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GPR35 Q9HC97 1/20 0.34

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
SCHEMBL612016 0.83 MAPK14 (0.41) MAPT
SCHEMBL21411357 0.78 ALDH1A1 (0.43) PTPN1PTPRFCA2PTPRAPOLB
SCHEMBL3607693 0.74 LCK (0.42) PTPN1PTPRFCA2
SCHEMBL3715444 0.70 PTPN2 (0.62) PTPN1MEN1KMT2AL3MBTL1
SCHEMBL31648042 0.70 CA2 (0.46) PTPN5CA2MAPTL3MBTL1
SCHEMBL6192110 0.69 LCK (0.38) PTPN1CA2
SCHEMBL14343926 0.68 IKBKB (0.39) L3MBTL1
SCHEMBL20572261 0.68 IKBKB (0.47) MAPTGSK3B
SCHEMBL20894252 0.67 GSK3B (0.42) PTPN1GSK3BGPR35
SCHEMBL31223032 0.67 GSK3B (0.36) POLBGSK3BGPR35

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
WO-2010101302-A1 THIENOPYRIMIDINE AS CDC7 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-10 WO disclosed
CN-101316851-A Thienopyrimidinone derivatives as melanin concentrating hormone receptor-1 antagonists BRISTOL MYERS SQUIBB CO (US) 2008-12-03 CN disclosed