SCHEMBL8337950

SCHEMBL8337950

CCOC(=O)c1cn(C2Cc3c(CC(=O)NC)cccc3C2=O)c(C(=O)O)n1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.35
GABRA2 P47869 5/20 0.35
GABRB2 P47870 5/20 0.35
CYP1A2 P05177 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
P2RX7 Q99572 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL8100183 0.95 GAA (0.36) GAAGABRA2GABRB2CYP1A2SMN1; SMN2
SCHEMBL8100190 0.93 SMN1; SMN2 (0.33) GAAGABRA2GABRB2CYP1A2SMN1; SMN2
SCHEMBL7844105 0.90 P2RX7 (0.34) P2RX7KDM4E
SCHEMBL8013343 0.87 GAA (0.38) GAAGABRA2GABRB2CYP1A2SMN1; SMN2
SCHEMBL7835755 0.85 ALDH1A1 (0.36) GAASMN1; SMN2LMNAP2RX7MAPT
SCHEMBL8099222 0.85 GAA (0.38) GAAGABRA2GABRB2CYP1A2P2RX7
SCHEMBL7820509 0.85 GAA (0.34) GAAGABRA2GABRB2CYP1A2TP53
SCHEMBL7820269 0.84 P2RY12 (0.37) GAAMEN1KMT2A
SCHEMBL8013354 0.82 GAA (0.36) GAAGABRA2GABRB2CYP1A2TP53
SCHEMBL8337317 0.81 GAA (0.36) GAAGABRA2GABRB2CYP1A2SMN1; SMN2

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-5902803-A 5H,10H-imidazo 1,2-a!indeno 1,2-e!pyrazin-4-one derivatives, preparation thereof, and drugs containing said derivatives RHONE-POULENC RORER S.A. (FR) 1999-05-11 US disclosed