SCHEMBL24424693

SCHEMBL24424693

Cc1n[nH]c2ccc(CNC(=O)C3CCN(C)CC3)cc12

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ LMNA P02545 2/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ GSK3B P49841 1/20 0.44
▸ MAPT P10636 2/20 0.43
▸ EPHX2 P34913 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ ERCC1 P07992 1/20 0.42
▸ ERCC4 Q92889 1/20 0.42
▸ WNT1 P04628 1/20 0.42
▸ DYRK1A Q13627 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ RET P07949 1/20 0.42

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
SCHEMBL24424717 0.81 CHRNA7 (0.51) ALDH1A1KDM4EHPGDALOX15LMNA
SCHEMBL25090838 0.78 MAPT (0.60) ALDH1A1KDM4EHPGDALOX15LMNA
SCHEMBL24424710 0.77 ACACB (0.43) ALDH1A1HPGDGSK3BEPHX2TP53
SCHEMBL24424092 0.77 KDM4E (0.47) ALDH1A1KDM4EHPGDALOX15LMNA
SCHEMBL24424559 0.76 KDM4E (0.52) ALDH1A1KDM4EHPGDALOX15LMNA
SCHEMBL12993901 0.76 ALDH1A1 (0.67) ALDH1A1LMNAMEN1KMT2ATP53
SCHEMBL29929246 0.76 TLR9 (0.66) —
SCHEMBL22463511 0.76 TLR9 (0.66) —
SCHEMBL23707380 0.75 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDALOX15LMNA
SCHEMBL13061265 0.75 ALDH1A1 (0.62) ALDH1A1KDM4EKMT2AMAPT

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
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 — — WO disclosed
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