SCHEMBL9823503

SCHEMBL9823503

Cc1ccccc1-c1nc(C(=O)Nc2nnn[nH]2)cs1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 3/20 0.48
TDP1 Q9NUW8 2/20 0.44
TLR7 Q9NYK1 8/20 0.44
MAP3K5 Q99683 1/20 0.41
MAPT P10636 1/20 0.41
NPY1R P25929 1/20 0.41
NPY2R P49146 1/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ACHE P22303 2/20 0.41
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
PRKD3 O94806 1/20 0.40
PRKCG P05129 1/20 0.40
PRKCB P05771 1/20 0.40
IL1R1 P14778 1/20 0.40
PRKCA P17252 1/20 0.40
TNFRSF1A P19438 1/20 0.40

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
SCHEMBL9823239 0.88 TDP1 (0.44) IRAK4TDP1TLR7MAPTNPY1R
SCHEMBL9823568 0.88 TDP1 (0.42) IRAK4TDP1TLR7MAP3K5MAPT
SCHEMBL9823137 0.87 HTR2B (0.53) IRAK4TDP1TLR7MAPTNPY1R
SCHEMBL9823486 0.86 HTR2B (0.52) IRAK4TDP1TLR7MAPTNPY1R
SCHEMBL9823416 0.85 IRAK4 (0.51) IRAK4TDP1TLR7ACHEHPGD
SCHEMBL9823609 0.84 IRAK4 (0.50) IRAK4TDP1TLR7ACHEHPGD
SCHEMBL9823630 0.84 IRAK4 (0.50) IRAK4TDP1TLR7ACHEHPGD
SCHEMBL9823477 0.84 TDP1 (0.64) IRAK4TDP1TLR7MAPTNPY1R
SCHEMBL9823191 0.84 IRAK4 (0.42) IRAK4TDP1TLR7MAPTNPY1R
SCHEMBL9823394 0.83 TDP1 (0.43) IRAK4TDP1TLR7MAPTNPY1R

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-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