SCHEMBL9568309

SCHEMBL9568309

CCOC(=O)c1c2n(c3c(OC)c(-c4ccccc4)c(F)cc3c1=O)C(c1ccccc1)S2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.39
MAPT P10636 5/20 0.39
HPGD P15428 5/20 0.39
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GRM6 O15303 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 1/20 0.37
POLB P06746 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
CSF1R P07333 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL9568349 0.94 MAPT (0.38) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL9568329 0.90 MAPT (0.41) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL9568299 0.90 MAPT (0.40) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL9568467 0.89 GSK3B (0.36) HPGDKDM4EPOLB
SCHEMBL9568305 0.85 MAPT (0.38) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL9568342 0.83 TOP1 (0.34)
SCHEMBL9568291 0.83 MAPT (0.37) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL9568346 0.83 TOP1 (0.40)
SCHEMBL9568340 0.81 MAPT (0.41) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL9568449 0.81 PRKCZ (0.38) ALDH1A1MAPTHPGDLMNASMN1; 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
EP-0551518-A1 QUINOLINECARBOXYLIC ACID DERIVATIVE NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-07-21 EP disclosed