SCHEMBL7728348

SCHEMBL7728348

Cc1ccc(CNNC(C)c2ccc(Cl)c(Cl)c2Cl)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.38
P2RX7 Q99572 2/20 0.37
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
RXFP1 Q9HBX9 1/20 0.34
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 2/20 0.33
CHRM2 P08172 1/20 0.33
POLB P06746 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TP53 P04637 1/20 0.32
GAA P10253 1/20 0.32
BRD4 O60885 1/20 0.32
BRD9 Q9H8M2 1/20 0.32
VDR P11473 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
SCHEMBL7193740 0.87 P2RX7 (0.44) SMN1; SMN2P2RX7KMT2AMEN1NPC1
SCHEMBL5269356 0.85 SMN1; SMN2 (0.50) SMN1; SMN2P2RX7KMT2AMEN1RXFP1
SCHEMBL7194394 0.81 SMN1; SMN2 (0.45) SMN1; SMN2P2RX7KMT2AMEN1NPC1
SCHEMBL7728512 0.77 POLB (0.42) SMN1; SMN2KMT2AMEN1ALDH1A1CHRM2
SCHEMBL5274512 0.76 SMN1; SMN2 (0.40) SMN1; SMN2KMT2AMEN1NPC1RAB9A
SCHEMBL7732172 0.76 SMN1; SMN2 (0.43) SMN1; SMN2P2RX7KMT2AMEN1NPC1
SCHEMBL7728377 0.75 POLB (0.44) SMN1; SMN2KMT2AMEN1NPC1ALDH1A1
SCHEMBL7729289 0.72 SMN1; SMN2 (0.37) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL5269340 0.72 SMN1; SMN2 (0.53) SMN1; SMN2P2RX7KMT2AMEN1ALDH1A1
SCHEMBL7194520 0.70 RAB9A (0.48) SMN1; SMN2KMT2AMEN1NPC1RAB9A

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
US-6403832-B1 MIXING ACID WITH AMINE, PRECIPITATING SALT, AND FILTERING; GOOD OPTICAL PURITY SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-06-11 US disclosed