SCHEMBL8635329

SCHEMBL8635329

Cc1cc(N(C)c2ccncc2)c(S(C)(=O)=O)cc1C(=O)Cl

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL8635012 0.87 NSD2 (0.36) SLC9A1L3MBTL1RXRARXRBRXRG
SCHEMBL8635629 0.86 FLT1 (0.36) SLC9A1RXRARXRBRXRGALDH1A1
SCHEMBL8634555 0.86 MKNK1 (0.38) L3MBTL1LMNASMN1; SMN2
SCHEMBL8635757 0.85 SMN1; SMN2 (0.31) ALDH1A1LMNASMN1; SMN2
SCHEMBL8635192 0.85 RXRA (0.35) SLC9A1L3MBTL1RXRARXRBRXRG
SCHEMBL8635732 0.84 KCNJ6 (0.38)
SCHEMBL8634267 0.83 KEAP1 (0.41) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL7761267 0.82 SLC9A1 (0.60) SLC9A1
SCHEMBL8636116 0.82 SLC9A1 (0.36) SLC9A1
SCHEMBL8633950 0.82 SIRT2 (0.35) SLC9A1RXRARXRBRXRG

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