SCHEMBL15964865

SCHEMBL15964865

NC(=O)c1nnc(Cc2ccc(F)cc2)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.39
PARP10 Q53GL7 1/20 0.39
TYMP P19971 1/20 0.38
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36
HPGD P15428 2/20 0.36
RXFP1 Q9HBX9 1/20 0.36
SIRT5 Q9NXA8 1/20 0.36
GRM2 Q14416 2/20 0.36
MAOA P21397 1/20 0.36
FYN P06241 1/20 0.36
GRK5 P34947 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
ALPL P05186 1/20 0.35
TSHR P16473 1/20 0.35
BRS3 P32247 1/20 0.35

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
SCHEMBL15964637 0.85 BRS3 (0.41) TYMPALDH1A1LMNAHPGDRXFP1
SCHEMBL15964741 0.85 SRD5A2 (0.40) PARP10TYMPALDH1A1GAABRS3
SCHEMBL3210485 0.83 PLA2G10 (0.49) ALDH1A1HPGDGAAMAPTPKM
SCHEMBL30091585 0.83 KDM5A (0.41) FYN
SCHEMBL15964837 0.82 HCAR2 (0.46) MAOBPARP10MAOA
SCHEMBL30091705 0.81 MMP13 (0.41) GRM2
SCHEMBL15964604 0.80 MEN1 (0.50) ALDH1A1LMNAHPGDMAPTNPSR1
SCHEMBL30091639 0.79 GPR52 (0.36) MAOB
SCHEMBL30091689 0.79 RPS6KB1 (0.38) PARP10
SCHEMBL30091570 0.78 GPR52 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3317269-B1 BICYCLIC LACTAMS AS RECEPTOR-INTERACTING PROTEIN-1 (RIP1) KINASE INHIBITORS FOR TREATING E.G. INFLAMMATORY DISEASES HOFFMANN LA ROCHE (CH) 2022-09-21 EP claimed
CN-111269221-B Bicyclic lactams and methods of use thereof 豪夫迈·罗氏有限公司 2023-09-26 CN disclosed
EP-3760625-A1 BICYCLIC LACTAMS AS RECEPTOR-INTERACTING PROTEIN-1 (RIP1) KINASE INHIBITORS FOR TREATING E.G. INFLAMMATORY DISEASES F. Hoffmann-La Roche AG (CH) 2021-01-06 EP disclosed
EP-3508484-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2019-07-10 EP disclosed
EP-3342771-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2018-07-04 EP disclosed
WO-2014125444-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2014-08-21 WO disclosed