SCHEMBL1661890

SCHEMBL1661890

CC(=O)c1ncc(C)c(Cl)n1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 1/20 0.40
POLB P06746 3/20 0.39
RPS6KA5 O75582 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTK2 Q05397 1/20 0.31
APLNR P35414 1/20 0.31
KMO O15229 1/20 0.30
SORD Q00796 1/20 0.30
RAB9A P51151 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
SCHEMBL28564917 0.84 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1MAPK1POLBMEN1
SCHEMBL18435733 0.79 MAPK1 (0.38) SMN1; SMN2ALDH1A1MAPK1POLBLMNA
SCHEMBL18179064 0.79 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1MAPK1POLBRXFP1
SCHEMBL24387170 0.76 MAPT (0.40) SMN1; SMN2ALDH1A1MAPK1POLBMEN1
SCHEMBL8582659 0.73 ALDH1A1 (0.33) ALDH1A1KMT2AAPLNR
SCHEMBL20844100 0.70
SCHEMBL311281 0.70
SCHEMBL25560063 0.69 PLAU (0.33)
SCHEMBL17820266 0.69 ALDH1A1 (0.35) ALDH1A1MAPK1LMNAL3MBTL1
SCHEMBL25559859 0.69 NTRK1 (0.44) SMN1; SMN2ALDH1A1MAPK1MEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488514-A1 INDOLE AND AZAINDOLE MODULATORS OF THE ALPHA 7 NACHR Proximagen Limited (GB) 2012-08-22 EP disclosed
WO-2011045353-A1 INDOLE AND AZAINDOLE MODULATORS OF THE ALPHA 7 NACHR PROXIMAGEN LIMITED (GB) 2011-04-21 WO disclosed