SCHEMBL9846220

SCHEMBL9846220

CCCc1cc(CCc2nc3c(Cl)ccc(Cl)c3o2)c(OC)nc1C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.32
ALOX15 P16050 1/20 0.32
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9846244 0.92 APOBEC3A (0.30)
SCHEMBL9283236 0.78 ALDH1A1 (0.41) MEN1ALDH1A1HPGDKMT2A
SCHEMBL9846156 0.78 ALOX5 (0.31) ALOX5ALOX15
SCHEMBL9846152 0.78 ALOX5 (0.31) ALOX5ALOX15
SCHEMBL9432051 0.76 APOBEC3A (0.33)
SCHEMBL9846391 0.75 MAPT (0.34)
SCHEMBL9846120 0.74 PPARD (0.33) HPGD
SCHEMBL9846106 0.73 PDE4A (0.34)
SCHEMBL9280809 0.70 ALDH1A1 (0.38) MEN1ALDH1A1HPGDKMT2A
SCHEMBL9284917 0.70 ALDH1A1 (0.35) MEN1ALDH1A1HPGDKMT2A

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