SCHEMBL6912296

SCHEMBL6912296

CC(=Nc1c(C)cc(C)cc1C)c1cc(C)cc(C(C)=Nc2c(C)cc(C)cc2C)n1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30
GRIN3A Q8TCU5 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
SCHEMBL6912292 1.00 KDM4E (0.33) KDM4EALDH1A1LMNAGAAMAPT
Hydrochloric Acid SCHEMBL7176570 0.96 KDM4E (0.31) KDM4EALDH1A1LMNAGAAMAPT
Hydrochloric Acid SCHEMBL7185035 0.96 KDM4E (0.31) KDM4EALDH1A1LMNAGAAMAPT
Hydrochloric Acid SCHEMBL7182017 0.96 KDM4E (0.31) KDM4EALDH1A1LMNAGAAMAPT
Hydrochloric Acid SCHEMBL7180404 0.96 KDM4E (0.31) KDM4EALDH1A1LMNAGAAMAPT
Hydrochloric Acid SCHEMBL7176713 0.96 KDM4E (0.31) KDM4EALDH1A1LMNAGAAMAPT
Hydrochloric Acid SCHEMBL7173214 0.96 KDM4E (0.31) KDM4EALDH1A1LMNAGAAMAPT
Hydrochloric Acid SCHEMBL7178354 0.96 KDM4E (0.31) KDM4EALDH1A1LMNAGAAMAPT
SCHEMBL14280817 0.89 RAPGEF4 (0.33)
SCHEMBL5587694 0.87 HCAR2 (0.32) KDM4EALDH1A1LMNAGAAMAPT

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
WO-2004074333-A2 PROCESS FOR HOMO- OR COPOLYMERIZATIONOF CONJUGATED OLEFINES DOW GLOBAL TECHNOLOGIES INC. (US) 2004-09-02 WO disclosed