SCHEMBL8636231

SCHEMBL8636231

CCc1cc(N(C)c2ccc(F)cc2)c(S(C)(=O)=O)cc1C(=O)Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31

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
SCHEMBL8634504 0.89 FLT1 (0.38) KMT2ARXRALMNAKDM4EMAPT
SCHEMBL8635203 0.88 HSP90AA1 (0.35) MCL1KMT2AL3MBTL1LMNATP53
SCHEMBL8635349 0.87 ALDH1A1 (0.39) KMT2ALMNAKDM4EMAPTHTT
SCHEMBL8632126 0.86 TUBB4A (0.37) KMT2ALMNAKDM4EALDH1A1
SCHEMBL8635757 0.86 SMN1; SMN2 (0.31) LMNAMAPTMAPK1ALDH1A1
SCHEMBL8635192 0.85 RXRA (0.35) KMT2AL3MBTL1RXRARXRBLMNA
SCHEMBL8634221 0.85 SIRT2 (0.34) LMNAALDH1A1PSEN1PSEN2APH1B
SCHEMBL8635259 0.83 ALDH1A1 (0.38) KMT2AALOX15ALDH1A1RIPK1
SCHEMBL7765534 0.83 SLC9A1 (0.45)
SCHEMBL8633117 0.81 PDE4B (0.40) KMT2ARXRARXRBLMNAMAPT

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