SCHEMBL28607223

SCHEMBL28607223

CC(C)(C)OC(=O)N1CCCC(n2ccc3c(Cl)nc(Cl)nc32)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 1/20 0.41
SRC P12931 4/20 0.40
EGFR P00533 2/20 0.40
FPR2 P25090 1/20 0.40
USP30 Q70CQ3 1/20 0.39
HPGDS O60760 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
BTK Q06187 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TRPV3 Q8NET8 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
ABL1 P00519 1/20 0.38
ABL2 P42684 1/20 0.38
BCHE P06276 1/20 0.37
HTR6 P50406 1/20 0.37

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
SCHEMBL13861581 0.86 SRC (0.48) HCAR1SRCEGFRFPR2HPGDS
SCHEMBL13861580 0.86 SRC (0.48) HCAR1SRCEGFRFPR2HPGDS
SCHEMBL28599393 0.84 MAPT (0.35) MAPTHTR6POLB
SCHEMBL28599391 0.84 MAPT (0.35) MAPTHTR6POLB
SCHEMBL30973451 0.83 HCAR1 (0.40) HCAR1SRCEGFRFPR2USP30
SCHEMBL17144495 0.82 HCAR1 (0.45) HCAR1SRCEGFRFPR2HPGDS
SCHEMBL17143824 0.82 HCAR1 (0.45) HCAR1SRCEGFRFPR2HPGDS
SCHEMBL17143823 0.82 HCAR1 (0.45) HCAR1SRCEGFRFPR2HPGDS
SCHEMBL30994032 0.80 SRC (0.42) HCAR1SRCEGFRFPR2USP30
SCHEMBL9950465 0.80 SRC (0.54) SRCEGFRUSP30ABL1ABL2

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
CN-113214265-B Pyrimidine five-membered ring compound 江苏先声药业有限公司 2023-07-07 CN disclosed
CN-113214265-A Pyrimido five-membered ring compounds 江苏先声药业有限公司 2021-08-06 CN disclosed