SCHEMBL14313611

SCHEMBL14313611

C[C@H]1CC[C@@H](N2CCC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 3/20 0.46
ALOX15 P16050 1/20 0.44
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 2/20 0.39
L3MBTL3 Q96JM7 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.35
MBTD1 Q05BQ5 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL13342157 1.00 KDM4E (0.46) KDM4EALDH1A1ALOX15MEN1KMT2A
SCHEMBL20245295 1.00 KDM4E (0.46) KDM4EALDH1A1ALOX15MEN1KMT2A
SCHEMBL736959 0.94 KDM4E (0.46) KDM4EALDH1A1ALOX15MEN1KMT2A
SCHEMBL9557835 0.94 KDM4E (0.46) KDM4EALDH1A1ALOX15MEN1KMT2A
SCHEMBL736459 0.94 KDM4E (0.46) KDM4EALDH1A1ALOX15MEN1KMT2A
SCHEMBL14175057 0.92 KDM4E (0.44) KDM4EALDH1A1ALOX15MEN1KMT2A
SCHEMBL3688411 0.92 KDM4E (0.44) KDM4EALDH1A1ALOX15MEN1KMT2A
SCHEMBL737910 0.92 KDM4E (0.44) KDM4EALDH1A1ALOX15MEN1KMT2A
SCHEMBL736102 0.92 KDM4E (0.44) KDM4EALDH1A1ALOX15MEN1KMT2A
SCHEMBL18976856 0.88 KDM4E (0.53) KDM4EALDH1A1ALOX15MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023142754-A1 EZH1/2 INHIBITOR, PREPARATION THEREOF, AND USE THEREOF IN ANTI-TUMOR THERAPY 江苏天士力帝益药业有限公司 2023-08-03 WO disclosed
WO-2008003958-A2 FUSED PYRIMIDO COMPOUNDS ASTRAZENECA AB (SE) 2008-01-10 WO disclosed