SCHEMBL16631558

SCHEMBL16631558

CCn1cc2c(F)c(C)[nH]c2nc1=O

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.30
MEN1 O00255 1/20 0.30
ABCC4 O15439 1/20 0.30
LMNA P02545 1/20 0.30
PKM P14618 1/20 0.30
PTGS1 P23219 1/20 0.30
KMT2A Q03164 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
SCHEMBL16631774 0.82 MEN1 (0.33) SMN1; SMN2ALDH1A1MEN1ABCC4LMNA
SCHEMBL16631758 0.81 LMNA (0.30) LMNA
SCHEMBL18081828 0.80 KDM4E (0.33) ALDH1A1
SCHEMBL16631772 0.79 KMT2A (0.32) SMN1; SMN2ALDH1A1MEN1ABCC4LMNA
SCHEMBL16631756 0.78 ADORA1 (0.34) LMNA
SCHEMBL18080608 0.76
SCHEMBL16631683 0.74 MEN1 (0.30) MEN1ABCC4LMNAPKMPTGS1
SCHEMBL18081977 0.71 KDM4E (0.31) ALDH1A1
SCHEMBL16631753 0.68 ADORA2A (0.49) SMN1; SMN2ALDH1A1MEN1ABCC4LMNA
SCHEMBL18080586 0.68

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-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 WO disclosed