SCHEMBL13747009

SCHEMBL13747009

CCN(CC)C1CCN(C(=O)Oc2cc(F)ccc2/C=C2\SC(N3CCCCN3P(=O)(O)O)=NC2=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.39
▸ KMT2A Q03164 9/20 0.39
▸ NPC1 O15118 4/20 0.38
▸ ACKR3 P25106 1/20 0.35
▸ CBX7 O95931 1/20 0.35
▸ CDYL2 Q8N8U2 1/20 0.35
▸ CDYL Q9Y232 1/20 0.35
▸ CDY1; CDY1B Q9Y6F8 1/20 0.35
▸ POLB P06746 1/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ GFER P55789 1/20 0.32
▸ PSMD14 O00487 1/20 0.32

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
SCHEMBL13747010 0.95 NPC1 (0.38) MEN1KMT2ANPC1ACKR3CBX7
SCHEMBL13616079 0.94 MEN1 (0.39) MEN1KMT2ANPC1ACKR3CBX7
SCHEMBL13616080 0.89 NPC1 (0.38) MEN1KMT2ANPC1ACKR3CBX7
SCHEMBL13616106 0.89 MEN1 (0.38) MEN1KMT2ANPC1ACKR3CBX7
SCHEMBL13747738 0.89 NPC1 (0.39) MEN1KMT2ANPC1POLBRAB9A
SCHEMBL13747082 0.88 MEN1 (0.37) MEN1KMT2ANPC1POLBRAB9A
SCHEMBL13746929 0.87 MEN1 (0.37) MEN1KMT2ANPC1POLBRAB9A
SCHEMBL13747079 0.85 NPC1 (0.42) MEN1KMT2ANPC1POLBRAB9A
SCHEMBL13616050 0.84 MEN1 (0.40) MEN1KMT2ANPC1ACKR3CBX7
SCHEMBL13616051 0.84 MEN1 (0.40) MEN1KMT2ANPC1ACKR3CBX7

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
WO-2009097695-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS CHLORION PHARMA, INC. (CA) 2009-08-13 — — WO disclosed
Send feedback