SCHEMBL26192157

SCHEMBL26192157

CC(C)(C)OC(=O)Nn1cnc2cnc(Cl)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 3/20 0.36
CDK9 P50750 1/20 0.35
TRPA1 O75762 1/20 0.34
ATR Q13535 1/20 0.34
STK17B O94768 1/20 0.34
STK17A Q9UEE5 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA3 P07451 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA13 Q8N1Q1 1/20 0.34
CA14 Q9ULX7 1/20 0.34
CA5B Q9Y2D0 1/20 0.34
MAPKAPK2 P49137 1/20 0.33
CCR9 P51686 1/20 0.33

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
SCHEMBL31543097 0.78 HSP90AA1 (0.39) JAK1CDK9CCR9LMNA
SCHEMBL31543369 0.78 HSP90AA1 (0.39) JAK1CDK9CCR9LMNA
SCHEMBL28575805 0.78 STK17B (0.43) JAK1TRPA1ATRSTK17BSTK17A
SCHEMBL30482406 0.77 MTNR1A (0.46) CDK9STK17BSTK17ASCN9A
SCHEMBL25378725 0.77 MTNR1A (0.46) CDK9STK17BSTK17ASCN9A
SCHEMBL4756322 0.71 NPC1 (0.44) JAK1LMNAKMT2ACYP1A2CYP3A4
SCHEMBL16879925 0.69 METAP1 (0.40) KMT2ASCN9ACYP3A4
SCHEMBL16332510 0.69 KDM4E (0.46) JAK1STK17BSTK17AMAPKAPK2LMNA
SCHEMBL12931891 0.69 ATR (0.47) TRPA1ATRSTK17BSTK17ACA12
SCHEMBL2768194 0.68 GSK3B (0.47) CDK9

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023146786-A1 IMIDAZOPYRIDINE INHIBITORS OF TYROSINE KINASE BRIDGENE BIOSCIENCES, INC. (US) 2023-08-03 WO disclosed