SCHEMBL8632612

SCHEMBL8632612

Cc1cc(Nc2nccs2)c(S(C)(=O)=O)cc1C(=O)Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 3/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
ADORA2A P29274 3/20 0.39
ADORA1 P30542 1/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
PPARG P37231 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
SCN1A P35498 1/20 0.38
SCN5A Q14524 1/20 0.38
SCN8A Q9UQD0 1/20 0.38
ACP1 P24666 2/20 0.37
HSD17B10 Q99714 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL8630815 0.86 ACP1 (0.40) SMN1; SMN2LMNAMEN1KMT2ANPC1
SCHEMBL7761274 0.83 SLC9A1 (0.58)
SCHEMBL8634301 0.81 SLC9A1 (0.36) SMN1; SMN2RAB9AALDH1A1
SCHEMBL8635344 0.78 KMT2A (0.36) KMT2AALDH1A1L3MBTL1
SCHEMBL8634805 0.77 TYK2 (0.48) SMN1; SMN2LMNAMEN1MAPK1KMT2A
SCHEMBL8633035 0.76 FDPS (0.33)
SCHEMBL8635463 0.74 AKR1C3 (0.45) MEN1KMT2AKDM4EALDH1A1POLB
SCHEMBL8634947 0.74 FFAR2 (0.34)
SCHEMBL8635848 0.74 CYP11B2 (0.46) LMNAMEN1KMT2ANPC1ALDH1A1
SCHEMBL8631102 0.73 AKR1C3 (0.47) LMNAMEN1KMT2AALDH1A1POLB

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