SCHEMBL9846155

SCHEMBL9846155

CCc1cc([S+]([O-])Cc2nc3c(Cl)ccc(Cl)c3o2)c(=O)[nH]c1C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 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
SCHEMBL9280809 0.79 ALDH1A1 (0.38) MEN1ALDH1A1HPGDKMT2A
L-697661 SCHEMBL29456987 0.77 FABP4 (0.34) MEN1ALDH1A1HPGDKMT2A
SCHEMBL9278617 0.77 MAPT (0.34) MEN1ALDH1A1HPGDKMT2A
L-697661 SCHEMBL599639 0.77 FABP4 (0.34) MEN1ALDH1A1HPGDKMT2A
SCHEMBL9846157 0.77 ALDH1A1 (0.32) MEN1ALDH1A1HPGDKMT2A
SCHEMBL9846178 0.76 ALDH1A1 (0.31) MEN1ALDH1A1HPGDKMT2A
SCHEMBL9846185 0.76 ALDH1A1 (0.31) MEN1ALDH1A1HPGDKMT2A
SCHEMBL9283236 0.75 ALDH1A1 (0.41) MEN1ALDH1A1HPGDKMT2A
SCHEMBL9284917 0.72 ALDH1A1 (0.35) MEN1ALDH1A1HPGDKMT2A
SCHEMBL8532577 0.71 TYMS (0.30) ALDH1A1

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
EP-0462800-A2 Inhibitors of HIV reverse transcriptase MERCK & CO. INC. (US) 1991-12-27 EP disclosed