SCHEMBL11266024

SCHEMBL11266024

COC(=O)C(c1nc(Oc2ccccc2)cc2ccccc12)(C(C)C)C(C)C=C(Cl)Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 1/20 0.35
PLA2G10 O15496 3/20 0.34
GAA P10253 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
LMNA P02545 2/20 0.34
CDC25B P30305 3/20 0.33
EGLN2 Q96KS0 4/20 0.32
EGLN1 Q9GZT9 2/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP1A2 P05177 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31
ATM Q13315 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL11269103 0.84 PLA2G10 (0.39) ALDH1A1KDM4EHPGDHSD17B10PLA2G10
SCHEMBL11268086 0.82 MEN1 (0.33) ALDH1A1KDM4EGAAL3MBTL1LMNA
SCHEMBL11283711 0.78 KDM4E (0.41) ALDH1A1KDM4EGAAL3MBTL1LMNA
SCHEMBL11307347 0.74 ALDH1A1 (0.32) ALDH1A1KDM4EHPGDHSD17B10PLA2G10
SCHEMBL11276788 0.74 SMN1; SMN2 (0.34) ALDH1A1KDM4EHPGDHSD17B10PLA2G10
SCHEMBL11273154 0.73 L3MBTL1 (0.38) ALDH1A1KDM4EHPGDHSD17B10PLA2G10
SCHEMBL11276175 0.73 CACNA1G (0.33) PLA2G10LMNAMEN1KMT2AMAPT
SCHEMBL11273179 0.73 FPR2 (0.37) ALDH1A1KDM4EGAAL3MBTL1MEN1
SCHEMBL11266217 0.72 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL11279536 0.72 P2RX3 (0.39) KDM4EL3MBTL1MEN1KMT2ACYP1A2

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
US-4338326-A PESTICIDES UNION CARBIDE CORPORATION (US) 1982-07-06 US disclosed