SCHEMBL8666404

SCHEMBL8666404

Cc1cn2cccc(OCc3c(Cl)ccc(NC(=O)c4ccc(Cl)cc4)c3Cl)c2n1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
BDKRB2 P30411 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GLA P06280 1/20 0.41

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
SCHEMBL8666299 0.95 BDKRB2 (0.42) SMN1; SMN2BDKRB2KDM4EMEN1MAPT
SCHEMBL8666464 0.93 BDKRB2 (0.40) SMN1; SMN2BDKRB2KDM4EALDH1A1
SCHEMBL8666461 0.92 PPARG (0.46) BDKRB2KDM4EMEN1MAPTKMT2A
SCHEMBL8666921 0.84 BDKRB2 (0.50) BDKRB2
SCHEMBL8563482 0.83 PPARG (0.42)
SCHEMBL8561192 0.82 BDKRB2 (0.59) BDKRB2
SCHEMBL8570185 0.82 BDKRB2 (0.43) BDKRB2
SCHEMBL8666936 0.80 LMNA (0.44) SMN1; SMN2NPSR1BDKRB2MAPTKMT2A
SCHEMBL8563420 0.80 PPARG (0.46)
SCHEMBL8667851 0.79 MEN1 (0.44) SMN1; SMN2BDKRB2KDM4EMEN1KMT2A

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-5750699-A HALOGENATING OF CORRESPONDING COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed