SCHEMBL9719264

SCHEMBL9719264

CCc1ccc(C(N=C2CCCCCCN2)C2CCC2)c(CC)c1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL9719261 1.00 MEN1 (0.31) MEN1ALDH1A1KMT2A
SCHEMBL9719268 1.00 MEN1 (0.31) MEN1ALDH1A1KMT2A
SCHEMBL11743615 0.73 ALOX12 (0.32)
SCHEMBL11743620 0.73 ALOX12 (0.32)
SCHEMBL7333528 0.72 IDO1 (0.36)
SCHEMBL7333523 0.72 IDO1 (0.36)
SCHEMBL7334296 0.72 CYP1A2 (0.36) ALDH1A1
SCHEMBL7386629 0.72 CYP1A2 (0.36) ALDH1A1
SCHEMBL7334291 0.72 CYP1A2 (0.36) ALDH1A1
SCHEMBL7328246 0.71 ALDH1A1 (0.41) MEN1ALDH1A1KMT2A

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-0370320-B1 LACTAMIMIDES IN THE TREATMENT OF DRUG-RESISTANT PROTOZOAL INFECTIONS MERRELL DOW PHARMACEUTICALS INC. (US) 1992-09-30 EP disclosed