SCHEMBL19320281

SCHEMBL19320281

Cc1cc(C)c(N(c2c(C)cc(C)cc2C)c2c(C)c(C)c(C)c(C)c2C)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.39
RAPGEF4 Q8WZA2 7/20 0.38
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
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
SCHEMBL19320282 1.00 ACHE (0.39) ACHERAPGEF4ALDH1A1KDM4ELMNA
SCHEMBL19320287 0.93 ACHE (0.35) ACHERAPGEF4
SCHEMBL19320279 0.91 ACHE (0.33) ACHERAPGEF4
SCHEMBL19320285 0.91 ACHE (0.33) ACHERAPGEF4
SCHEMBL19320283 0.89 ACHE (0.32) ACHERAPGEF4
SCHEMBL19320286 0.89 ACHE (0.32) ACHERAPGEF4
SCHEMBL13053162 0.88 RAPGEF4 (0.45) ACHERAPGEF4ALDH1A1KDM4ELMNA
SCHEMBL19320288 0.82 RAPGEF4 (0.30) RAPGEF4
SCHEMBL19320289 0.82 RAPGEF4 (0.30) RAPGEF4
SCHEMBL19320284 0.80

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
US-20170253795-A1 POLYMER COMPOUND AND LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-09-07 US disclosed