SCHEMBL13005185

SCHEMBL13005185

O=S1(=O)OCCC1CC1CC2C=CC1C2

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 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
SCHEMBL4445948 0.71 KDM4E (0.48) KDM4EALDH1A1TSHR
SCHEMBL6290027 0.67 KDM4E (0.40) KDM4EALDH1A1TSHR
SCHEMBL6290727 0.66 KDM4E (0.39) KDM4EALDH1A1TSHR
SCHEMBL22590372 0.66 KDM4E (0.36) KDM4EALDH1A1TSHR
SCHEMBL121798 0.65 KDM4E (0.41) KDM4EALDH1A1TSHR
SCHEMBL20712568 0.65 KDM4E (0.41) KDM4EALDH1A1TSHR
SCHEMBL6905710 0.64 KDM4E (0.32) KDM4EALDH1A1
SCHEMBL15467915 0.64 ALDH1A1 (0.43) KDM4EALDH1A1TSHR
SCHEMBL9473130 0.63
SCHEMBL1809222 0.63

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
US-7851575-B2 Polycyclic polymers containing pendant ion conducting moieties PROMERUS LLC (US) 2010-12-14 US disclosed
US-20080242750-A1 Polycyclic polymers containing pendant ion conducting moieties PROMERUS LLC 2008-10-02 US disclosed
US-7312292-B2 Polycyclic polymers containing pendant ion conducting moieties PROMERUS LLC (US) 2007-12-25 US disclosed