SCHEMBL24424559

SCHEMBL24424559

CN1CCC(C(=O)NCc2ccc3[nH]ccc3c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ ALOX15 P16050 1/20 0.52
▸ MAPT P10636 2/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ CHRM4 P08173 2/20 0.47
▸ LMNA P02545 2/20 0.46
▸ ROCK2 O75116 1/20 0.46
▸ NAMPT P43490 1/20 0.45
▸ LTA4H P09960 1/20 0.45
▸ TP53 P04637 2/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ ERCC1 P07992 1/20 0.44
▸ ERCC4 Q92889 1/20 0.44
▸ CHRNA7 P36544 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ METAP2 P50579 1/20 0.44

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
SCHEMBL27731712 0.88 WDR5 (0.47) ALDH1A1MAPTKMT2ALMNAROCK2
SCHEMBL25090838 0.83 MAPT (0.60) KDM4EALDH1A1HPGDALOX15MAPT
SCHEMBL25090827 0.82 KLKB1 (0.47) KDM4EALDH1A1HPGDALOX15MEN1
SCHEMBL27711111 0.81 ABL1 (0.45) KDM4EALDH1A1MAPTLMNAROCK2
SCHEMBL24423574 0.81 DYRK1A (0.44) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL24424092 0.77 KDM4E (0.47) KDM4EALDH1A1HPGDALOX15MAPT
SCHEMBL24424717 0.77 CHRNA7 (0.51) KDM4EALDH1A1HPGDALOX15MAPT
SCHEMBL24424693 0.76 ALDH1A1 (0.47) KDM4EALDH1A1HPGDALOX15MAPT
SCHEMBL22606800 0.76 CHRM4 (0.55) MAPTCHRM4ERCC1ERCC4KCNH2
SCHEMBL8372164 0.76 MEN1 (0.61) ALDH1A1HPGDMAPTMEN1KMT2A

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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