SCHEMBL8699319

SCHEMBL8699319

CCc1cc(NC(=O)N2CCN(c3ccc(Br)cc3)CC2)c(OC)nc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.45
MAPT P10636 9/20 0.44
ALDH1A1 P00352 4/20 0.44
LMNA P02545 2/20 0.44
TP53 P04637 2/20 0.44
KMT2A Q03164 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 2/20 0.44
DGAT1 O75907 3/20 0.43
KDM4E B2RXH2 2/20 0.41
PDGFRB P09619 1/20 0.41
KIT P10721 1/20 0.41
PDGFRA P16234 1/20 0.41
FLT3 P36888 1/20 0.41
GAA P10253 1/20 0.41
USP2 O75604 2/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 2/20 0.41
POLB P06746 1/20 0.41
ALOX15 P16050 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
SCHEMBL8703929 0.92 RBP4 (0.47) RBP4MAPTALDH1A1LMNATP53
SCHEMBL8703304 0.91 MAPT (0.55) RBP4MAPTALDH1A1LMNATP53
SCHEMBL8703466 0.91 MAPT (0.48) RBP4MAPTALDH1A1LMNATP53
SCHEMBL8704891 0.90 MAPT (0.53) RBP4MAPTALDH1A1LMNATP53
SCHEMBL8704931 0.90 RBP4 (0.57) RBP4MAPTALDH1A1LMNATP53
SCHEMBL8703619 0.89 GAA (0.48) RBP4MAPTALDH1A1LMNATP53
SCHEMBL8702942 0.89 MAPT (0.53) RBP4MAPTALDH1A1LMNATP53
SCHEMBL8703751 0.88 MAPT (0.48) RBP4MAPTALDH1A1LMNATP53
SCHEMBL9057828 0.88 MAPT (0.53) MAPTALDH1A1LMNATP53KMT2A
SCHEMBL8704733 0.88 PANK3 (0.49) RBP4MAPTALDH1A1LMNATP53

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-5780472-A ANTITUMOR AGENTS SAMJIN PHARMACEUTICAZL CO., LTD. (KR) 1998-07-14 US disclosed