SCHEMBL8633117

SCHEMBL8633117

CCc1cc(N(C)c2cccc(Cl)c2)c(S(C)(=O)=O)cc1C(=O)Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.40
MAPT P10636 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 2/20 0.38
USP2 O75604 1/20 0.38
RORC P51449 3/20 0.35
ALDH1A1 P00352 1/20 0.35
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
HTT P42858 1/20 0.34
HTR3E A5X5Y0 1/20 0.34
HTR3B O95264 1/20 0.34
HTR3A P46098 1/20 0.34
HTR3D Q70Z44 1/20 0.34
HTR3C Q8WXA8 1/20 0.34
FLT1 P17948 1/20 0.34
FLT4 P35916 1/20 0.34
KDR P35968 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
SCHEMBL8635203 0.88 HSP90AA1 (0.35) MEN1KMT2ALMNAALDH1A1
SCHEMBL8635349 0.88 ALDH1A1 (0.39) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL8634504 0.87 FLT1 (0.38) MAPTMEN1KMT2ALMNARORC
SCHEMBL8638285 0.86 PDE4B (0.41) PDE4BMAPTMEN1KMT2ALMNA
SCHEMBL8635879 0.86 MTNR1A (0.43) LMNAALDH1A1
SCHEMBL7761342 0.85
SCHEMBL8633199 0.85 PER2 (0.36)
SCHEMBL8634234 0.82 MEN1 (0.36) MEN1KMT2ARORC
SCHEMBL8633074 0.82 CYP3A4 (0.37) MAPTLMNAALDH1A1HTT
SCHEMBL8636231 0.81 MCL1 (0.33) MAPTKMT2ALMNAALDH1A1RXRA

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