SCHEMBL28989609

SCHEMBL28989609

COC(=O)Cc1nc(Cl)cc(N2CCCC2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
ADORA2A P29274 2/20 0.39
ADORA1 P30542 2/20 0.39
USP2 O75604 1/20 0.37
SLC2A1 P11166 1/20 0.37
MAPT P10636 5/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
TP53 P04637 1/20 0.36
APAF1 O14727 1/20 0.36
GAA P10253 1/20 0.36
PPP1CA P62136 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
GBA1 P04062 2/20 0.36
KMT2A Q03164 3/20 0.35
HPGD P15428 2/20 0.35
MEN1 O00255 2/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL28989534 0.81 HSP90AB1 (0.44) LMNAUSP2MAPTALDH1A1KDM4E
SCHEMBL2021817 0.78 LMNA (0.41) LMNAADORA2AADORA1MAPTALDH1A1
SCHEMBL2027503 0.76 SORD (0.45) LMNAMAPTKMT2ASMN1; SMN2
SCHEMBL2021947 0.76 CYP1A2 (0.44) MAPTKMT2ASMN1; SMN2
SCHEMBL15317599 0.75 ALDH1A1 (0.43) LMNAUSP2MAPTALDH1A1KDM4E
SCHEMBL21157766 0.75 CRHBP (0.42) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL3242401 0.73 CYP1A2 (0.37) LMNAMAPTALDH1A1GBA1KMT2A
SCHEMBL3716189 0.73 LMNA (0.46) LMNAUSP2ALDH1A1KDM4EGBA1
SCHEMBL28989611 0.73 LMNA (0.41) LMNAALDH1A1GBA1KMT2AHPGD
SCHEMBL15317600 0.73 CYP2C19 (0.49) ADORA2AADORA1MAPTALDH1A1KDM4E

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-115996932-A New macrocyclic LRRK2 kinase inhibitors 法国施维雅药厂 2023-04-21 CN disclosed