SCHEMBL9176299

SCHEMBL9176299

Cc1nc2[nH]c(=O)n(C)c(=O)c2n1Cc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.65
HPGD P15428 3/20 0.65
BRAF P15056 1/20 0.49
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KMT2A Q03164 4/20 0.48
GPR18 Q14330 1/20 0.48
POLB P06746 4/20 0.47
MAPT P10636 4/20 0.47
CXCL8 P10145 2/20 0.47
NOD2 Q9HC29 2/20 0.47
NOD1 Q9Y239 2/20 0.47
TNF P01375 1/20 0.47
G6PD P11413 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
PAX8 Q06710 1/20 0.47
TLR9 Q9NR96 1/20 0.47
MEN1 O00255 3/20 0.46
ALDH1A1 P00352 3/20 0.46

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
SCHEMBL7441558 0.87 KDM4E (0.56) KDM4EHPGDBRAFLMNASMN1; SMN2
SCHEMBL556003 0.87 KDM4E (0.55) KDM4EHPGDBRAFLMNASMN1; SMN2
SCHEMBL7430972 0.85 KDM4E (0.53) KDM4EHPGDBRAFLMNASMN1; SMN2
SCHEMBL7434786 0.83 HPGD (0.51) KDM4EHPGDBRAFLMNASMN1; SMN2
SCHEMBL28749924 0.80 TSHR (0.50) KDM4EHPGDLMNASMN1; SMN2KMT2A
SCHEMBL9707747 0.80 KDM4E (0.44) KDM4EHPGDGPR18
SCHEMBL6348692 0.79 BRAF (0.72) KDM4EBRAFKMT2APOLBMAPT
SCHEMBL28094075 0.77 ALDH1A1 (0.41) KDM4EHPGDLMNAMAPTALDH1A1
SCHEMBL16028369 0.76 GPR18 (0.55) KDM4EHPGDBRAFSMN1; SMN2KMT2A
SCHEMBL27399997 0.75 ALDH1A1 (0.42) KDM4EHPGDLMNAKMT2AGPR18

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-5393755-A Hypotensive agents, enzyme inhibitors SCHERING CORPORATION (US) 1995-02-28 US disclosed