SCHEMBL9823352

SCHEMBL9823352

O=C(Nc1nnn[nH]1)c1csc(-c2ccc3ccccc3n2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.42
RAB9A P51151 7/20 0.41
NPC1 O15118 5/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
TLR7 Q9NYK1 5/20 0.40
IRAK4 Q9NWZ3 3/20 0.39
MAPT P10636 4/20 0.39
ATM Q13315 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
NPY1R P25929 1/20 0.39
NPY2R P49146 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NFKB1 P19838 2/20 0.39
NFKB2 Q00653 2/20 0.39

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
SCHEMBL9823432 0.83 TLR7 (0.50) TDP1TLR7
SCHEMBL9823477 0.82 TDP1 (0.64) TDP1RAB9ANPC1KMT2AMEN1
SCHEMBL9823605 0.81 MAPT (0.41) TDP1RAB9ANPC1KMT2AMEN1
SCHEMBL11495341 0.81 RAB9A (0.58) TDP1RAB9ANPC1KMT2AMEN1
SCHEMBL9823394 0.80 TDP1 (0.43) TDP1RAB9ANPC1KMT2AMEN1
SCHEMBL9823137 0.80 HTR2B (0.53) TDP1RAB9ANPC1KMT2AMEN1
SCHEMBL9831310 0.79 RAB9A (0.40) RAB9ANPC1KMT2AMEN1CASP3
SCHEMBL9823503 0.79 IRAK4 (0.48) TDP1TLR7IRAK4MAPTATM
SCHEMBL9823486 0.79 HTR2B (0.52) TDP1RAB9ANPC1KMT2AMEN1
SCHEMBL9823239 0.79 TDP1 (0.44) TDP1TLR7IRAK4MAPTATM

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