SCHEMBL30283775

SCHEMBL30283775

CN(C)C(=O)c1cccc(-c2ccccc2)c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.60
KMO O15229 1/20 0.60
PDK2 Q15119 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ERCC5 P28715 1/20 0.50
FEN1 P39748 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAP4K1 Q92918 1/20 0.50
KEAP1 Q14145 1/20 0.49
NFE2L2 Q16236 1/20 0.49
KCNA5 P22460 1/20 0.49
HSD17B2 P37059 2/20 0.49
HSD17B1 P14061 1/20 0.49
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49

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
SCHEMBL1135975 1.00 ERN1 (0.60) ERN1KMOPDK2HDAC8MEN1
Hydrochloric Acid SCHEMBL28646857 0.98 ERN1 (0.59) ERN1KMOPDK2HDAC8MEN1
Trifluoroacetic Acid SCHEMBL5067780 0.90 PDK2 (0.57) ERN1KMOPDK2HDAC8MEN1
SCHEMBL27876786 0.90 SMN1; SMN2 (0.55) ERN1KMOPDK2HDAC8MEN1
SCHEMBL12168605 0.90 ERN1 (0.58) ERN1KMOPDK2LMNA
SCHEMBL18311613 0.87 ERN1 (0.64) ERN1PDK2MEN1KMT2AHSD17B2
SCHEMBL17795214 0.87 ERN1 (0.60) ERN1KMOPDK2CYP3A4MAP4K1
SCHEMBL28022357 0.85 KMO (0.56) ERN1KMOHDAC8MEN1KMT2A
SCHEMBL12472078 0.84 ERN1 (0.56) ERN1PDK2CYP3A4MAP4K1HSD17B2
SCHEMBL12469445 0.84 ERN1 (0.59) ERN1PDK2CYP3A4MAP4K1KEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115427409-B Pyrimidine-4 (3H) -one derivatives as TRPV4 antagonists 拉夸里亚创药株式会社 2025-02-25 CN claimed
CN-119192174-A Novel biphenyl carboxylic FXR agonist, preparation method thereof and application thereof as medicine 广东药科大学 2024-12-27 CN claimed
CN-117255792-A Heteroaryl derivatives, process for preparing the same and pharmaceutical compositions comprising the same as active ingredient 沃若诺伊公司 2023-12-19 CN claimed
CN-119677740-A Tertiary amine substituted bicyclic compounds useful as T cell activators 百时美施贵宝公司 2025-03-21 CN disclosed
CN-115427409-B Pyrimidine-4 (3H) -one derivatives as TRPV4 antagonists 拉夸里亚创药株式会社 2025-02-25 CN disclosed
CN-119192174-A Novel biphenyl carboxylic FXR agonist, preparation method thereof and application thereof as medicine 广东药科大学 2024-12-27 CN disclosed
CN-115776890-A TRPV4 inhibitors as therapeutic agents for eye diseases 拉夸里亚创药株式会社 2023-03-10 CN disclosed