SCHEMBL5597461

SCHEMBL5597461

CC(C)C1=[C]c2ccccc2C1c1cccc2cccnc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.38
COPS5 Q92905 1/20 0.38
TP53 P04637 5/20 0.36
MAPT P10636 4/20 0.36
CYP2D6 P10635 2/20 0.36
HIF1A Q16665 2/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MMP2 P08253 2/20 0.36
TSHR P16473 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GMNN O75496 1/20 0.36
HSP90AA1 P07900 1/20 0.36
CYP3A4 P08684 1/20 0.36
MMP9 P14780 1/20 0.36
ALOX15 P16050 1/20 0.36
NFKB1 P19838 1/20 0.36
MMP8 P22894 1/20 0.36
CCR1 P32246 1/20 0.36

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
SCHEMBL7546290 0.78 MAPK1 (0.37) PSMD14COPS5TP53MAPTCYP2D6
SCHEMBL5509833 0.78 MAPT (0.36) PSMD14COPS5TP53MAPTCYP2D6
SCHEMBL536400 0.77 LMNA (0.37) PSMD14COPS5TP53MAPTCYP2D6
Hydrochloric Acid SCHEMBL1072267 0.70 CCR1 (0.40) PSMD14COPS5TP53MAPTCYP2D6
SCHEMBL28517555 0.70 KDM4E (0.54) PSMD14COPS5TP53MAPTCYP2D6
SCHEMBL6131362 0.66 LMNA (0.42) PSMD14COPS5TP53MAPTCYP2D6
Hydrochloric Acid SCHEMBL1071469 0.65 SMN1; SMN2 (0.43) PSMD14COPS5TP53MAPTCYP2D6
SCHEMBL7547386 0.64 LMNA (0.38) PSMD14COPS5TP53MAPTCYP2D6
Hydrochloric Acid SCHEMBL1072120 0.64 ALDH1A1 (0.43) PSMD14COPS5TP53MAPTCYP2D6
SCHEMBL23308887 0.64 PSMD14 (0.40) PSMD14COPS5TP53MAPTCYP2D6

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
EP-1740626-A1 CATALYST SYSTEM FOR OLEFIN POLYMERIZATION, ITS PRODUCTION AND USE Basell Polyolefine GmbH (DE) 2007-01-10 EP disclosed
WO-2005103099-A1 CATALYST SYSTEM FOR OLEFIN POLYMERIZATION, ITS PRODUCTION AND USE BASELL POLYOLEFINE GMBH (DE) 2005-11-03 WO disclosed