SCHEMBL25376743

SCHEMBL25376743

CCCC[C@@](C)(N)CNC(=O)c1cnn(C)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ LMNA P02545 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ GRN P28799 1/20 0.41
▸ SORT1 Q99523 1/20 0.41
▸ DHX9 Q08211 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ KDM1A O60341 3/20 0.36
▸ L3MBTL1 Q9Y468 3/20 0.35
▸ HTT P42858 1/20 0.35
▸ MAP4K1 Q92918 1/20 0.35
▸ MAPT P10636 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ MAPK8 P45983 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ KLKB1 P03952 1/20 0.34
▸ RCOR1 Q9UKL0 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ ADORA2B P29275 1/20 0.34

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
SCHEMBL25376747 1.00 SMN1; SMN2 (0.46) SMN1; SMN2LMNAHPGDGRNSORT1
Hydrochloric Acid SCHEMBL29099900 0.99 SMN1; SMN2 (0.45) SMN1; SMN2LMNAHPGDGRNSORT1
Hydrochloric Acid SCHEMBL29099902 0.99 SMN1; SMN2 (0.45) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL25376436 0.82 SMN1; SMN2 (0.44) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL25376440 0.82 SMN1; SMN2 (0.44) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL25374512 0.78 SMN1; SMN2 (0.41) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL25374519 0.78 SMN1; SMN2 (0.41) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL25376152 0.78 L3MBTL1 (0.34) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL25376158 0.78 L3MBTL1 (0.34) SMN1; SMN2LMNAHPGDGRNSORT1
SCHEMBL3318854 0.75 SMN1; SMN2 (0.60) SMN1; SMN2LMNAHPGDGRNSORT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4484426-A1 PYRIMIDO AROMATIC RING COMPOUND AND USE THEREOF IN DRUG Sunshine Lake Pharma Co., Ltd. (CN) 2025-01-01 — — EP disclosed
CN-116693527-A Pyrimido aromatic ring compounds and application thereof in medicines 广东东阳光药业股份有限公司 2023-09-05 — — CN disclosed
WO-2023160527-A1 PYRIMIDO AROMATIC RING COMPOUND AND USE THEREOF IN DRUG 广东东阳光药业股份有限公司 2023-08-31 — — WO disclosed
US-9656949-B2 Substituted carboxylic acid derivatives as aggrecanase inhibitors for the treatment of osteoarthritis MERCK PATENT GMBH (DE) 2017-05-23 — — US disclosed
Send feedback