SCHEMBL30797974

SCHEMBL30797974

CC(C)(C)OC(=O)NCCCCOCCNc1cc(-c2ccoc2)cc2c1cnn2C1CCCCO1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 5/20 0.44
▸ RXRA P19793 1/20 0.35
▸ RXRB P28702 1/20 0.35
▸ RXRG P48443 1/20 0.35
▸ ATRIP Q8WXE1 2/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ BRD4 O60885 3/20 0.33
▸ TLR2 O60603 1/20 0.33
▸ TLR1 Q15399 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ MIF P14174 1/20 0.33
▸ CYP1A1 P04798 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2B6 P20813 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ CYP3A43 Q9HB55 1/20 0.33
▸ PLK1 P53350 2/20 0.32
▸ CNR2 P34972 1/20 0.32

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
SCHEMBL30797688 0.88 ATR (0.44) ATRRXRARXRBRXRGATRIP
SCHEMBL30797547 0.88 ATR (0.42) ATRRXRARXRBRXRGADORA3
SCHEMBL30797611 0.87 ATR (0.47) ATRRXRARXRBRXRGATRIP
SCHEMBL30797857 0.86 ATR (0.41) ATRRXRARXRBRXRGBRD4
SCHEMBL30797677 0.86 ATR (0.41) ATRRXRARXRBRXRGATRIP
SCHEMBL30797873 0.86 ATR (0.41) ATRRXRARXRBRXRGADORA2A
SCHEMBL27377168 0.86 ATR (0.41) ATRRXRARXRBRXRGADORA2A
SCHEMBL27377014 0.86 ATR (0.41) ATRRXRARXRBRXRGATRIP
SCHEMBL30797730 0.86 ATR (0.44) ATRRXRARXRBRXRGATRIP
SCHEMBL27377509 0.85 ATR (0.47) ATRRXRARXRBRXRGATRIP

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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