SCHEMBL5733833

SCHEMBL5733833

Cc1nc(-c2ccncc2)sc1C(=O)N1CCN(S(=O)(=O)c2cc3ccc(Cl)cc3o2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.44
MAPT P10636 1/20 0.43
OXTR P30559 1/20 0.43
ALDH1A1 P00352 1/20 0.42
CDC7 O00311 3/20 0.40
DBF4 Q9UBU7 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
F10 P00742 6/20 0.39
F2 P00734 2/20 0.39
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
THRA P10827 2/20 0.39
THRB P10828 2/20 0.39
RAB9A P51151 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL5735802 0.93 CNR1 (0.44) CNR1MAPTOXTRALDH1A1CDC7
SCHEMBL5735603 0.90 OXTR (0.43) CNR1MAPTOXTRALDH1A1CDC7
SCHEMBL5734359 0.84 F10 (0.54) MAPTF10F2SMN1; SMN2ATM
SCHEMBL5735531 0.83 MAPT (0.53) CNR1MAPTOXTRALDH1A1L3MBTL1
SCHEMBL6725737 0.82 LSS (0.50) ALDH1A1L3MBTL1F10KMT2AATM
SCHEMBL5735605 0.82 OXTR (0.42) CNR1MAPTOXTRALDH1A1CDC7
SCHEMBL5735064 0.81 LSS (0.54) CNR1MAPTOXTRALDH1A1L3MBTL1
SCHEMBL5737420 0.81 F10 (0.56) CNR1MAPTOXTRALDH1A1CDC7
SCHEMBL5734679 0.81 F10 (0.44) CNR1MAPTOXTRALDH1A1L3MBTL1
SCHEMBL5733266 0.80 MAPT (0.43) CNR1MAPTOXTRALDH1A1CDC7

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
EP-0986551-B1 SULFONAMIDE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA PHARMACEUTICAL (JP) 2006-08-02 EP disclosed
US-6359134-B1 ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-03-19 US disclosed
EP-0986551-A1 SULFONAMIDE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Pharmaceutical Company Limited (JP) 2000-03-22 EP disclosed
WO-1998054164-A1 SULFONAMIDE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-03 WO disclosed