SCHEMBL30797579

SCHEMBL30797579

CC(C)(C)OC(=O)NCCCCOCCNc1cc(-c2cnns2)nc2c1cnn2C1CCCCO1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 4/20 0.41
▸ BRD4 O60885 7/20 0.33
▸ SYK P43405 1/20 0.32
▸ FPR3 P25089 2/20 0.31
▸ FPR2 P25090 2/20 0.31
▸ ATRIP Q8WXE1 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.31
▸ ADORA2A P29274 1/20 0.31
▸ ADORA1 P30542 1/20 0.31
▸ TTK P33981 1/20 0.31
▸ ALOX5AP P20292 1/20 0.31
▸ DDB1 Q16531 1/20 0.31
▸ CRBN Q96SW2 1/20 0.31
▸ TLR2 O60603 1/20 0.31
▸ TLR1 Q15399 1/20 0.31

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
SCHEMBL30797892 0.88 ATR (0.42) ATRBRD4
SCHEMBL30797897 0.87 ATR (0.46) ATRBRD4ATRIPADORA3ADORA2A
SCHEMBL30797724 0.84 ATR (0.43) ATRBRD4SYKFPR3FPR2
SCHEMBL30797730 0.79 ATR (0.44) ATRBRD4FPR3FPR2ATRIP
SCHEMBL30797700 0.79 ATR (0.47) ATRBRD4FPR3FPR2ATRIP
SCHEMBL30869078 0.79 ATR (0.45) ATRBRD4FPR3FPR2ADORA3
SCHEMBL30797851 0.78 ATR (0.43) ATRBRD4FPR3FPR2ATRIP
SCHEMBL30869074 0.78 ATR (0.43) ATRBRD4FPR3FPR2ATRIP
SCHEMBL30797685 0.77 ATR (0.46) ATRBRD4
SCHEMBL27377168 0.77 ATR (0.41) ATRBRD4FPR3FPR2ADORA2A

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-4584266-A1 NOVEL COMPOUNDS, COMPOSITIONS AND THERAPEUTIC USES THEREOF Cambridge Enterprise Limited (GB) 2025-07-16 — — EP disclosed
WO-2024052701-A1 NOVEL COMPOUNDS, COMPOSITIONS AND THERAPEUTIC USES THEREOF CAMBRIDGE ENTERPRISE LIMITED (GB) 2024-03-14 — — WO disclosed
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