SCHEMBL16579986

SCHEMBL16579986

CNCC1CC2(CCNCC2)C1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.32
MAOB P27338 1/20 0.32
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 1/20 0.31
PIM1 P11309 1/20 0.30
FLT3 P36888 1/20 0.30
PIM3 Q86V86 1/20 0.30
PIM2 Q9P1W9 1/20 0.30

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
SCHEMBL30019777 0.82 KDM1A (0.33) KDM1AMAOB
SCHEMBL16579959 0.80 GNAI3 (0.35) KDM1AMAOB
SCHEMBL14768884 0.79 PIM1 (0.31) PIM1FLT3PIM3PIM2
SCHEMBL255863 0.78 SIGMAR1 (0.32)
SCHEMBL14297527 0.76 TSHR (0.33) KDM1AMAOBKDM4E
SCHEMBL22704494 0.75 CARM1 (0.31) KDM4E
SCHEMBL18633184 0.73 L3MBTL1 (0.31) KDM1A
SCHEMBL22704373 0.73 KDM4E (0.34) KDM4E
SCHEMBL15653919 0.73 EPHX1 (0.39) KDM1AMAOBKDM4EKMT2A
SCHEMBL904100 0.73 APLNR (0.44) KDM1AMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023017446-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed
WO-2023018237-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed
WO-2015038426-A1 SELF-IMMOLATIVE LINKERS CONTAINING MANDELIC ACID DERIVATIVES, DRUG-LIGAND CONJUGATES FOR TARGETED THERAPIES AND USES THEREOF ASANA BIOSCIENCES, LLC (US) 2015-03-19 WO disclosed