SCHEMBL30529282

SCHEMBL30529282

CCN(CC)c1ccc2cc(C(=O)OC)c(=O)[nH]c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.46
▸ ALDH1A1 P00352 6/20 0.44
▸ KDM4E B2RXH2 6/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ MAPT P10636 4/20 0.44
▸ HSD17B10 Q99714 4/20 0.44
▸ HPGD P15428 3/20 0.44
▸ ATM Q13315 3/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ USP2 O75604 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ SLC16A3 O15427 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ SLC16A1 P53985 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ TSHR P16473 2/20 0.41
▸ PDE3B Q13370 1/20 0.41
▸ PDE3A Q14432 1/20 0.41

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
SCHEMBL25426199 1.00 MAOB (0.46) MAOBALDH1A1KDM4EMEN1KMT2A
SCHEMBL30529281 0.85 ALDH1A1 (0.56) MAOBALDH1A1KDM4EMEN1KMT2A
SCHEMBL31273751 0.85 KDM4E (0.44) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL25427065 0.85 ALDH1A1 (0.56) MAOBALDH1A1KDM4EMEN1KMT2A
SCHEMBL31423310 0.81 DAO (0.62) ALDH1A1KDM4EMAPTHSD17B10HPGD
SCHEMBL31423177 0.80 DAO (0.56) ALDH1A1KDM4EHSD17B10TSHRPOLB
SCHEMBL10330638 0.78 KDM4E (0.61) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL31273131 0.78 DAO (0.51) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL31422905 0.77 BRD4 (0.39) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL24373361 0.77 CHEK1 (0.51) ALDH1A1KDM4EHSD17B10L3MBTL1TSHR

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-116472269-A Compositions and methods for treating muscular dystrophy 加利福尼亚大学董事会 2023-07-21 — — CN disclosed
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