SCHEMBL9823285

SCHEMBL9823285

CC(C)c1ccc(-c2nc(C(=O)Nc3nnn[nH]3)cs2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.50
GAA P10253 2/20 0.50
MAPT P10636 5/20 0.47
LMNA P02545 3/20 0.47
HPGD P15428 2/20 0.46
TLR7 Q9NYK1 7/20 0.46
TDP1 Q9NUW8 2/20 0.45
NPC1 O15118 1/20 0.45
POLB P06746 1/20 0.45
ATM Q13315 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
NPY1R P25929 1/20 0.45
NPY2R P49146 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HDAC1 Q13547 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HPGDS O60760 1/20 0.43

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
SCHEMBL9823541 0.89 RAB9A (0.61) RAB9AGAAMAPTLMNAHPGD
SCHEMBL9823799 0.87 RAB9A (0.61) RAB9AGAAMAPTLMNAHPGD
SCHEMBL9823214 0.86 TLR7 (0.49) RAB9AGAAMAPTLMNAHPGD
SCHEMBL9823539 0.86 MAPT (0.60) RAB9AGAAMAPTLMNAHPGD
SCHEMBL9823477 0.85 TDP1 (0.64) RAB9AGAAMAPTLMNAHPGD
SCHEMBL9823576 0.84 LMNA (0.50) RAB9AGAAMAPTLMNAHPGD
SCHEMBL9823479 0.84 TLR7 (0.61) RAB9AGAAMAPTLMNAHPGD
Monoethanolamine SCHEMBL10553577 0.81 RAB9A (0.53) RAB9AGAAMAPTLMNAHPGD
SCHEMBL9823543 0.79 IRAK4 (0.57) RAB9AGAAMAPTLMNAHPGD
SCHEMBL9823593 0.79 IRAK4 (0.66) RAB9AGAAMAPTTLR7NPC1

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