SCHEMBL3456484

SCHEMBL3456484

O=C(CC1C2CC3CC1CC(CC(=O)N(Cl)c1ccccc1)(C3)C2)Nc1ccccc1Cl

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 10/20 0.59
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL3456480 0.88 P2RX7 (0.77) P2RX7TDP1L3MBTL1MEN1KMT2A
SCHEMBL4207060 0.82 P2RX7 (0.67) P2RX7KMT2A
SCHEMBL6940565 0.76 P2RX7 (1.00) P2RX7MEN1KMT2A
SCHEMBL4207053 0.69 P2RX7 (0.85) P2RX7MEN1KMT2A
SCHEMBL27826899 0.65 P2RX7 (0.56) P2RX7L3MBTL1
SCHEMBL11884308 0.61 P2RX7 (1.00) P2RX7MEN1KMT2A
SCHEMBL6941699 0.61 P2RX7 (0.70) P2RX7MEN1KMT2A
SCHEMBL6939890 0.61 P2RX7 (0.70) P2RX7MEN1KMT2A
SCHEMBL9311985 0.61 KMT2A (0.75) P2RX7L3MBTL1MEN1KMT2A
SCHEMBL1199010 0.61 P2RX7 (0.66) P2RX7

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-2239012-A2 Pharmaceutical use of substituted amides High Point Pharmaceuticals, LLC (US) 2010-10-13 EP disclosed