SCHEMBL21574089

SCHEMBL21574089

CB(c1c(C)cc(C)cc1C)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 2/20 0.36
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2A6 P11509 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
SCHEMBL20624613 0.79 RAPGEF4 (0.36) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL13858501 0.75 RAPGEF4 (0.41) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL7911234 0.75 RAPGEF4 (0.41) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL1157695 0.71 RAPGEF4 (0.50) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL9945964 0.70 RAPGEF4 (0.38) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL9623685 0.69 RAPGEF4 (0.48) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL2125698 0.69 RAPGEF4 (0.41) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL23542825 0.67 RAPGEF4 (0.39) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL357015 0.67 RAPGEF4 (0.39) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL8966366 0.67 RAPGEF4 (0.39) RAPGEF4KDM4EALDH1A1LMNAGAA

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
EP-3067361-B1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2019-11-20 EP disclosed