SCHEMBL12569005

SCHEMBL12569005

OCCCCCCCCCCOCC1CC2C=CC1C2

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.34
ALDH1A1 P00352 1/20 0.34
EPHX2 P34913 1/20 0.32
TSHR P16473 1/20 0.31
POLB P06746 1/20 0.30
ALOX15 P16050 1/20 0.30
GBA1 P04062 2/20 0.30
UGCG Q16739 2/20 0.30
GBA2 Q9HCG7 2/20 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
SCHEMBL15462770 0.93 KDM4E (0.36) KDM4EALDH1A1EPHX2TSHRPOLB
SCHEMBL19708381 0.92 KDM4E (0.39) KDM4EALDH1A1EPHX2TSHR
SCHEMBL19689444 0.92 KDM4E (0.39) KDM4EALDH1A1EPHX2TSHR
SCHEMBL19689466 0.92 KDM4E (0.39) KDM4EALDH1A1EPHX2TSHR
SCHEMBL12748073 0.90 KDM4E (0.34) KDM4EALDH1A1TSHRPOLBALOX15
SCHEMBL415516 0.90 KDM4E (0.40) KDM4EALDH1A1EPHX2TSHR
SCHEMBL121824 0.86 KDM4E (0.38) KDM4EALDH1A1TSHRPOLBALOX15
SCHEMBL415515 0.86 KDM4E (0.40) KDM4EALDH1A1EPHX2TSHR
SCHEMBL11527033 0.84 ALDH1A1 (0.45) KDM4EALDH1A1GBA1GBA2
SCHEMBL13888541 0.84 KDM4E (0.34) KDM4EALDH1A1TSHR

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
US-7960479-B2 Brush copolymers CONOPCO, INC. (US) 2011-06-14 US disclosed
US-20100022741-A1 BRUSH COPOLYMERS CONOPCO, INC. D/B/A UNILEVER 2010-01-28 US disclosed