SCHEMBL9823477

SCHEMBL9823477

O=C(Nc1nnn[nH]1)c1csc(-c2ccccc2)n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.64
TLR7 Q9NYK1 4/20 0.60
HDAC1 Q13547 1/20 0.59
HDAC8 Q9BY41 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
MAPT P10636 4/20 0.58
ATM Q13315 2/20 0.58
NPSR1 Q6W5P4 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
NPY1R P25929 1/20 0.58
NPY2R P49146 1/20 0.58
LMNA P02545 3/20 0.55
HPGD P15428 2/20 0.55
IRAK4 Q9NWZ3 2/20 0.55
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.55
ALDH1A1 P00352 1/20 0.55
GAA P10253 1/20 0.55
KMT2A Q03164 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL9823539 0.91 MAPT (0.60) TDP1TLR7HDAC1HDAC8HDAC6
SCHEMBL9823214 0.89 TLR7 (0.49) TDP1TLR7HDAC1HDAC8HDAC6
SCHEMBL9823541 0.89 RAB9A (0.61) TDP1TLR7HDAC1HDAC8HDAC6
SCHEMBL9823593 0.88 IRAK4 (0.66) TLR7HDAC6MAPTATMIRAK4
SCHEMBL9823799 0.88 RAB9A (0.61) TDP1TLR7HDAC1HDAC8HDAC6
SCHEMBL9823543 0.86 IRAK4 (0.57) TDP1TLR7HDAC1HDAC8HDAC6
SCHEMBL9823137 0.85 HTR2B (0.53) TDP1TLR7HDAC1HDAC8HDAC6
SCHEMBL9823576 0.85 LMNA (0.50) TDP1TLR7HDAC1HDAC8HDAC6
SCHEMBL9823285 0.85 RAB9A (0.50) TDP1TLR7HDAC1HDAC8HDAC6
SCHEMBL9823479 0.85 TLR7 (0.61) TDP1TLR7MAPTLMNAHPGD

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