SCHEMBL8635848

SCHEMBL8635848

Cc1cc(Nc2cccnc2)c(S(C)(=O)=O)cc1C(=O)Cl

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.46
NPC1 O15118 2/20 0.43
PDE4B Q07343 1/20 0.42
BRAF P15056 1/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
ATM Q13315 1/20 0.42
ALDH1A1 P00352 2/20 0.41
TP53 P04637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NAMPT P43490 2/20 0.41
CSF1R P07333 1/20 0.40
ALPL P05186 1/20 0.40

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
SCHEMBL8635462 0.86 PDE4B (0.41) NPC1PDE4BALDH1A1TP53NAMPT
SCHEMBL8635344 0.85 KMT2A (0.36) KMT2AALDH1A1
SCHEMBL8635463 0.85 AKR1C3 (0.45) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL7766569 0.84 SLC9A1 (0.56)
SCHEMBL8635252 0.81 AKR1C3 (0.50) NPC1PDE4BKMT2AMEN1LMNA
SCHEMBL8632908 0.80 PTGS1 (0.43) KMT2AMEN1LMNA
SCHEMBL8631102 0.79 AKR1C3 (0.47) KMT2AMEN1LMNAMAPTALDH1A1
SCHEMBL8634301 0.79 SLC9A1 (0.36) ALDH1A1
SCHEMBL8637536 0.78 AKR1C3 (0.51) NPC1PDE4BKMT2AMEN1LMNA
SCHEMBL8633408 0.78 ALDH1A1 (0.39) NPC1ALDH1A1

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-1057999-C 4-Aminobenzoylguanidine derivatives MERCK PATENT GMBH (DE) 2000-11-01 CN disclosed
US-5739142-A 4-aminobenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-04-14 US disclosed
CN-1138575-A 4-aminobenzoylguanidine derivatives MERCK PATENT GMBH (DE) 1996-12-25 CN disclosed