SCHEMBL8635246

SCHEMBL8635246

CCc1cc(N(c2ccccc2)c2ccccc2)c(S(C)(=O)=O)cc1C(=O)Cl

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
BCAT2 O15382 1/20 0.34
NSD2 O96028 1/20 0.34
ESR1 P03372 1/20 0.34
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
RECQL P46063 1/20 0.34
ESR2 Q92731 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GLA P06280 1/20 0.33
TSHR P16473 1/20 0.33

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 0.90 HSP90AA1 (0.35) LMNAALDH1A1TP53SMN1; SMN2BCAT2
SCHEMBL8634362 0.85 NSD2 (0.40) BCAT2NSD2ESR1POLBAPEX1
SCHEMBL8634309 0.82 SLC9A1 (0.31)
SCHEMBL7766603 0.82 SLC9A1 (0.49)
SCHEMBL8634234 0.81 MEN1 (0.36) SMN1; SMN2ESR1POLBMEN1KMT2A
SCHEMBL8633117 0.81 PDE4B (0.40) LMNAALDH1A1MEN1KMT2A
SCHEMBL8635259 0.80 ALDH1A1 (0.38) ALDH1A1ESR1KMT2A
SCHEMBL8635349 0.80 ALDH1A1 (0.39) LMNAALDH1A1SMN1; SMN2POLBTDP1
SCHEMBL8633074 0.79 CYP3A4 (0.37) LMNAALDH1A1TP53TSHR
SCHEMBL8634504 0.79 FLT1 (0.38) LMNAALDH1A1MEN1KMT2ATSHR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5739142-A 4-aminobenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-04-14 US disclosed