SCHEMBL30617431

SCHEMBL30617431

CN(CC1CCC(=O)N1)C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 4/20 0.38
▸ CRBN Q96SW2 4/20 0.38
▸ BRD4 O60885 1/20 0.35
▸ CREBBP Q92793 1/20 0.35
▸ IRAK4 Q9NWZ3 2/20 0.35
▸ LMNA P02545 1/20 0.34
▸ TACR1 P25103 3/20 0.34
▸ KCNA5 P22460 3/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ NFKB2 Q00653 1/20 0.33
▸ RELA Q04206 1/20 0.33
▸ PDCD1 Q15116 2/20 0.32
▸ CD274 Q9NZQ7 2/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ SLC6A4 P31645 1/20 0.32
▸ SPR P35270 1/20 0.32
▸ ASGR1 P07306 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
SCHEMBL25070943 1.00 DDB1 (0.38) DDB1CRBNBRD4CREBBPIRAK4
SCHEMBL28903468 0.84 DDB1 (0.35) DDB1CRBNBRD4CREBBPIRAK4
SCHEMBL38664462 0.83 DDB1 (0.34) DDB1CRBNIRAK4LMNATACR1
SCHEMBL25664268 0.83 DDB1 (0.34) DDB1CRBNIRAK4LMNATACR1
SCHEMBL24687471 0.81 DDB1 (0.33) DDB1CRBNIRAK4LMNATACR1
SCHEMBL24722595 0.76 DDB1 (0.33) DDB1CRBNIRAK4
SCHEMBL14473849 0.74 GHSR (0.38) —
SCHEMBL22001577 0.74 BRD4 (0.32) BRD4CREBBP
SCHEMBL15358117 0.74 GHSR (0.38) —
SCHEMBL16529770 0.74 GHSR (0.38) —

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
CN-112041311-B PD-1/PD-L1 inhibitors 吉利德科学公司 2023-10-03 — — CN disclosed
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