SCHEMBL5510757

SCHEMBL5510757

CC(C)N1C(=O)Cc2cc(N)ccc21.[Fe]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BMPR1B O00238 9/20 0.48
BMPR1A P36894 9/20 0.48
ACVRL1 P37023 9/20 0.48
ACVR1 Q04771 9/20 0.48
TGFBR1 P36897 6/20 0.48
ATAD2 Q6PL18 1/20 0.44
CYP19A1 P11511 1/20 0.35
P2RX3 P56373 1/20 0.35
BRD4 O60885 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
RAD52 P43351 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL4201949 0.98 BMPR1B (0.49) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL27361980 0.85 BMPR1B (0.40) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL8126458 0.84 ATAD2 (0.59) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL5501201 0.84 ATAD2 (0.43) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL5107121 0.83 ATAD2 (0.48) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL5116354 0.82 ATAD2 (0.43) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL2061861 0.81 ATAD2 (0.49) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL14528011 0.80 BMPR1B (0.50) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL25315122 0.79 BMPR1B (0.49) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL22667214 0.79 BMPR1B (0.52) BMPR1BBMPR1AACVRL1ACVR1TGFBR1

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-1869029-A1 AN OXINDOLE OXAZOLIDINONE AS ANTIBACTERIAL AGENT Pharmacia & Upjohn Company LLC (US) 2007-12-26 EP disclosed
WO-2006106426-A1 AN OXINDOLE OXAZOLIDINONE AS ANTIBACTERIAL AGENT PHARMACIA & UPJOHN COMPANY LLC (US) 2006-10-12 WO disclosed