SCHEMBL2802019

SCHEMBL2802019

C1=CC(N(c2ccccc2)c2ccc3ccccc3c2)(N(c2ccccc2)c2ccc3ccccc3c2)C=CC1c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.31
MAOA P21397 2/20 0.31
MAOB P27338 2/20 0.31
KDM4E B2RXH2 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
CYP2C19 P33261 1/20 0.30
SLC6A3 Q01959 1/20 0.30
INSR P06213 1/20 0.30
IGF1R P08069 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
SCHEMBL8209205 0.96
SCHEMBL5148248 0.89 ALDH1A1 (0.35) MAOACYP1A2
SCHEMBL8211332 0.86 CYP1A2 (0.32) MAOACYP1A2CYP3A4
SCHEMBL21500411 0.84 SIGMAR1 (0.32)
SCHEMBL6711335 0.83 PKM (0.30)
SCHEMBL4882781 0.82 KDM1A (0.31) KDM1AMAOAMAOBKDM4EINSR
SCHEMBL8201869 0.80 ALDH1A1 (0.37) CYP3A4
SCHEMBL1255774 0.80 CYP2C19 (0.35) CYP2C19
SCHEMBL5579448 0.80 HTT (0.33) KDM1AKDM4ECYP1A2SLC6A2SLC6A4
SCHEMBL710236 0.79 ALDH1A1 (0.33) MAOBCYP3A4CYP2C9SLC6A2SLC6A4

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-10461269-B2 Crosslinkable, /polymerizable and combinations thereof charge-transporting molecular glass mixtures, luminescent molecular glass mixtures, or combinations thereof for organic light emitting diodes and other organic electronics and photonics applications and method of making same MOLECULAR GLASSES, INC. (US) 2019-10-29 US disclosed
EP-2262030-A2 Organic light emitting device THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2010-12-15 EP disclosed
EP-0977288-A2 Electron-injecting layer formed from a dopant layer for organic light-emitting structure EASTMAN KODAK COMPANY (US) 2000-02-02 EP disclosed