SCHEMBL27411178

SCHEMBL27411178

COc1nc2ccc(Cl)c(-c3ncnn3C)c2nc1OC

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 1/20 0.33
HRH4 Q9H3N8 2/20 0.32
CRHR1 P34998 3/20 0.31
PDE10A Q9Y233 1/20 0.30
RORC P51449 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30

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
SCHEMBL7680475 0.83 HRH4 (0.36) BDKRB2HRH4
SCHEMBL27477222 0.72 PDPK1 (0.37) HRH4PDE10A
SCHEMBL27434416 0.72 CYP1A2 (0.35) CRHR1RORC
SCHEMBL27476597 0.71 MAPT (0.42) RORC
SCHEMBL16583445 0.70 ALDH1A1 (0.35)
SCHEMBL27413977 0.69 SMN1; SMN2 (0.39) RORC
SCHEMBL27555336 0.69 NPC1 (0.36) HRH4RORC
SCHEMBL27476598 0.68 SMN1; SMN2 (0.39) RORC
SCHEMBL27413424 0.67 NQO2 (0.36) HRH4
SCHEMBL27434418 0.67 ALDH1A1 (0.43)

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
CN-1103770-C Quinoxalinediones PFIZER RES AND DEV CO N V S A (IE) 2003-03-26 CN disclosed
CN-1213369-A Quinoxalinedione compound PFIZER RES & DEV (IE) 1999-04-07 CN disclosed