SCHEMBL11525232

SCHEMBL11525232

O=C(CBr)c1ccc(Cl)c(S(=O)(=O)NC2CCCC2)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ MAPT P10636 5/20 0.50
▸ TP53 P04637 5/20 0.50
▸ LMNA P02545 4/20 0.49
▸ CNR2 P34972 1/20 0.48
▸ BRD4 O60885 1/20 0.47
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ TDP1 Q9NUW8 1/20 0.44
▸ MAPK1 P28482 1/20 0.43
▸ GSTO1 P78417 1/20 0.43

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
SCHEMBL11527071 0.99 ALDH1A1 (0.52) ALDH1A1L3MBTL1MAPTTP53LMNA
SCHEMBL11595283 0.88 CNR2 (0.54) ALDH1A1L3MBTL1MAPTTP53LMNA
SCHEMBL11595563 0.88 CNR2 (0.54) ALDH1A1L3MBTL1MAPTTP53LMNA
SCHEMBL11633948 0.86 CNR2 (0.50) ALDH1A1MAPTLMNACNR2MEN1
SCHEMBL5508282 0.85 ALDH1A1 (0.51) ALDH1A1L3MBTL1MAPTTP53LMNA
SCHEMBL11635788 0.85 CNR2 (0.52) ALDH1A1LMNACNR2KMT2ATDP1
SCHEMBL11568661 0.84 ALDH1A1 (0.50) ALDH1A1L3MBTL1MAPTTP53LMNA
SCHEMBL5504001 0.84 ALDH1A1 (0.50) ALDH1A1L3MBTL1MAPTTP53LMNA
SCHEMBL5508077 0.84 ALDH1A1 (0.50) ALDH1A1L3MBTL1MAPTTP53LMNA
SCHEMBL11346990 0.84 ALDH1A1 (0.50) ALDH1A1L3MBTL1MAPTTP53LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4156735-A SALIDIURETICS HOECHST AKTIENGESELLSCHAFT (DE) 1979-05-29 — — US disclosed
US-4118501-A SALIDIURETIC ACTIVITY HOECHST AKTIENGESELLSCHAFT (DE) 1978-10-03 — — US disclosed
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