SCHEMBL9823191

SCHEMBL9823191

CC(=O)Oc1ccccc1-c1nc(C(=O)Nc2nnn[nH]2)cs1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 5/20 0.42
TDP1 Q9NUW8 2/20 0.40
TLR7 Q9NYK1 7/20 0.40
ACHE P22303 2/20 0.38
MAOA P21397 1/20 0.38
LMNA P02545 2/20 0.38
PDE5A O76074 1/20 0.38
GAA P10253 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
MAPT P10636 1/20 0.38
NPY1R P25929 1/20 0.38
NPY2R P49146 1/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PRKD3 O94806 1/20 0.37
PRKCG P05129 1/20 0.37
PRKCB P05771 1/20 0.37

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
SCHEMBL9823416 0.89 IRAK4 (0.51) IRAK4TDP1TLR7ACHEMAOA
SCHEMBL9823609 0.88 IRAK4 (0.50) IRAK4TDP1TLR7ACHEMAOA
SCHEMBL9823630 0.88 IRAK4 (0.50) IRAK4TDP1TLR7ACHEMAOA
SCHEMBL9823503 0.84 IRAK4 (0.48) IRAK4TDP1TLR7ACHEMAPT
SCHEMBL9823239 0.84 TDP1 (0.44) IRAK4TDP1TLR7ACHEMAPT
SCHEMBL10553815 0.83 PTGER1 (0.50) TDP1TLR7LMNAMAPTNPY1R
SCHEMBL9823490 0.82 CNR2 (0.42) IRAK4TLR7PDE5A
SCHEMBL9823137 0.82 HTR2B (0.53) IRAK4TDP1TLR7LMNAGAA
SCHEMBL9823486 0.81 HTR2B (0.52) IRAK4TDP1TLR7LMNAGAA
SCHEMBL9823568 0.81 TDP1 (0.42) IRAK4TDP1TLR7ACHEMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0262873-B1 N-TETRAZOLYL THIAZOLECARBOXAMIDE DERIVATIVES AND THEIR USE SAWAI PHARMACEUTICAL CO., LTD. (JP) 1991-08-21 EP disclosed
US-4879295-A ANTIALLERGENS SAWAI PHARMACEUTICAL CO., LTD. (JP) 1989-11-07 US disclosed
EP-0262873-A1 N-tetrazolyl thiazolecarboxamide derivatives and their use SAWAI PHARMACEUTICAL CO., LTD. (JP) 1988-04-06 EP disclosed