SCHEMBL9823494

SCHEMBL9823494

O=C(Nc1nnn[nH]1)c1csc(-c2ccco2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 5/20 0.40
RAB9A P51151 5/20 0.40
KMT2A Q03164 5/20 0.40
NPC1 O15118 4/20 0.40
MEN1 O00255 4/20 0.40
HSD17B10 Q99714 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TP53 P04637 1/20 0.40
GLA P06280 1/20 0.40
MAPT P10636 3/20 0.40
ALOX15 P16050 2/20 0.40
PKM P14618 1/20 0.40
TSHR P16473 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
TLR7 Q9NYK1 2/20 0.39
IRAK4 Q9NWZ3 1/20 0.38
NPY1R P25929 1/20 0.38
NPY2R P49146 1/20 0.38

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
Monoethanolamine SCHEMBL9823193 0.93 PIM1 (0.38) KDM4ETDP1ALDH1A1RAB9AKMT2A
SCHEMBL9823477 0.81 TDP1 (0.64) KDM4ETDP1ALDH1A1RAB9AKMT2A
SCHEMBL9823539 0.80 MAPT (0.60) TDP1RAB9AKMT2ANPC1MEN1
SCHEMBL9823438 0.79 RAB9A (0.55) KDM4ETDP1RAB9AKMT2ANPC1
SCHEMBL9823137 0.79 HTR2B (0.53) KDM4ETDP1ALDH1A1RAB9AKMT2A
SCHEMBL9823503 0.78 IRAK4 (0.48) TDP1MAPTL3MBTL1TLR7IRAK4
SCHEMBL9823239 0.78 TDP1 (0.44) TDP1MAPTL3MBTL1TLR7IRAK4
SCHEMBL9823486 0.78 HTR2B (0.52) KDM4ETDP1ALDH1A1RAB9AKMT2A
SCHEMBL9823432 0.78 TLR7 (0.50) TDP1TLR7MAP3K5
SCHEMBL9829473 0.78 KDM4E (0.42) KDM4ETDP1ALDH1A1RAB9AKMT2A

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