SCHEMBL29007784

SCHEMBL29007784

CN(C)C1CN(c2ccc(-n3cc(C(=O)O)c(=O)c4cc(Cl)c(F)cc43)cn2)C1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ MAPK8 P45983 1/20 0.40
▸ MCHR1 Q99705 6/20 0.39
▸ MELK Q14680 4/20 0.37
▸ ATM Q13315 1/20 0.36
▸ ATR Q13535 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36

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
SCHEMBL30181041 1.00 LMNA (0.43) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL29007745 0.93 LMNA (0.48) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL30181102 0.89 NPC1 (0.45) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL29007911 0.89 NPC1 (0.45) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL31024942 0.87 LMNA (0.43) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL30416714 0.87 LMNA (0.45) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL29007927 0.83 LMNA (0.38) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL30181201 0.83 LMNA (0.38) LMNAMEN1KMT2AKDM4EALDH1A1
SCHEMBL30416962 0.83 MAPK8 (0.42) LMNAMEN1KMT2AKDM4EMAPK8
SCHEMBL31157557 0.82 LMNA (0.38) LMNAMEN1KMT2AKDM4EALDH1A1

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-116157392-A Compounds targeting RNA binding proteins or RNA modification proteins 雷多纳治疗公司 2023-05-23 — — CN disclosed
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