SCHEMBL6891227

SCHEMBL6891227

COCCNC(=O)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
TSHR P16473 1/20 0.62
LMNA P02545 1/20 0.60
KDM4E B2RXH2 1/20 0.60
HTT P42858 1/20 0.60
POLB P06746 1/20 0.56
EPHX2 P34913 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
GLA P06280 1/20 0.53
ATM Q13315 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL5858380 0.82 MEN1 (0.57) ALDH1A1MEN1KMT2ATSHRLMNA
SCHEMBL7778488 0.80 KDM4E (0.57) ALDH1A1MEN1KMT2ALMNAKDM4E
SCHEMBL28504782 0.80 KDM4E (0.57) ALDH1A1MEN1KMT2ATSHRLMNA
SCHEMBL15545516 0.79 HTT (0.55) ALDH1A1MEN1KMT2ALMNAKDM4E
SCHEMBL7778418 0.79 KDM4E (0.64) ALDH1A1MEN1KMT2ALMNAKDM4E
SCHEMBL28334704 0.78 KDM4E (0.68) ALDH1A1MEN1KMT2AKDM4EHTT
SCHEMBL17702625 0.77 KMT2A (0.70) ALDH1A1MEN1KMT2ALMNAKDM4E
SCHEMBL8655345 0.77 KDM4E (0.66) ALDH1A1MEN1KMT2AKDM4EHTT
SCHEMBL13873443 0.77 HTT (0.66) ALDH1A1MEN1KMT2AKDM4EHTT
SCHEMBL16064965 0.76 HTT (0.60) ALDH1A1MEN1KMT2ALMNAKDM4E

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
EP-1412398-A2 HIGH MELT STRENGTH POLYMERS AND METHOD OF MAKING SAME DOW GLOBAL TECHNOLOGIES INC. (US) 2004-04-28 EP disclosed
WO-2002100906-A1 USE OF POLAR MONOMERS IN OLEFIN POLYMERIZATION AND POLYMERS THEREOF DOW GLOBAL TECHNOLOGIES INC. (US) 2002-12-19 WO disclosed
WO-2002074816-A2 HIGH MELT STRENGTH POLYMERS AND METHOD OF MAKING SAME DOW GLOBAL TECHNOLOGIES INC. (US) 2002-09-26 WO disclosed