SCHEMBL28559151

SCHEMBL28559151

NC(=O)OC[C@H]1CC[C@@H](N)CC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 4/20 0.38
PARP10 Q53GL7 4/20 0.38
PARP2 Q9UGN5 2/20 0.38
SLC1A3 P43003 4/20 0.36
SLC1A2 P43004 4/20 0.36
SLC1A1 P43005 4/20 0.36
LMNA P02545 2/20 0.36
ALOX15 P16050 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
ALOX5 P09917 1/20 0.34
SMYD3 Q9H7B4 1/20 0.33
PTGIR P43119 2/20 0.31
PTGDR Q13258 1/20 0.31
CPB2 Q96IY4 1/20 0.30
PLG P00747 1/20 0.30
PLAT P00750 1/20 0.30

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
SCHEMBL2633968 1.00 PARP15 (0.38) PARP15PARP10PARP2SLC1A3SLC1A2
SCHEMBL2633967 1.00 PARP15 (0.38) PARP15PARP10PARP2SLC1A3SLC1A2
Hydrochloric Acid SCHEMBL28568896 0.98 PARP15 (0.37) PARP15PARP10PARP2SLC1A3SLC1A2
Hydrochloric Acid SCHEMBL28568895 0.98 PARP15 (0.37) PARP15PARP10PARP2SLC1A3SLC1A2
SCHEMBL111361 0.91
SCHEMBL30427433 0.91 PARP15 (0.42) PARP15PARP10PARP2SLC1A3SLC1A2
Hydrochloric Acid SCHEMBL28974199 0.89
SCHEMBL28479090 0.83 PARP15 (0.38) PARP15PARP10PARP2SLC1A3SLC1A2
SCHEMBL5861626 0.83 LMNA (0.48) PARP15PARP10PARP2SLC1A3SLC1A2
SCHEMBL28615281 0.83 PARP15 (0.38) PARP15PARP10PARP2SLC1A3SLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118103074-A Cytotoxic targeting chimeras for CCR2 expressing cells 葛兰素史克知识产权发展有限公司 2024-05-28 CN disclosed
CN-107793360-B Indoleamine 2, 3-dioxygenase inhibitor and application thereof 南京药捷安康生物科技有限公司 2021-05-28 CN disclosed
CN-107793360-A Indoleamine 2,3 dioxygenase inhibitors and application 南京药捷安康生物科技有限公司 2018-03-13 CN disclosed