SCHEMBL18821318

SCHEMBL18821318

N=C(N)c1ccc2ccccc2c1-c1ccc(C2(c3ccccc3)c3ccccc3-c3c2ccc2ccccc32)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ WDR5 P61964 1/20 0.35
▸ DHFR P00374 1/20 0.33
▸ TYMS P04818 1/20 0.33
▸ SOS1 Q07889 1/20 0.31
▸ F2 P00734 1/20 0.30
▸ F10 P00742 1/20 0.30
▸ PLAU P00749 1/20 0.30
▸ PLAT P00750 1/20 0.30
▸ KLKB1 P03952 1/20 0.30
▸ PRSS1 P07477 1/20 0.30
▸ PRSS2 P07478 1/20 0.30
▸ F7 P08709 1/20 0.30
▸ PRSS3 P35030 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
SCHEMBL18821316 0.99 KDM4E (0.35) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL20405181 0.85 DHFR (0.33) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL20405513 0.85 KDM4E (0.30) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL20405009 0.85 KDM4E (0.30) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL29557713 0.82 MAPT (0.42) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL15676320 0.82 MAPT (0.42) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL23655251 0.82 KDM4E (0.38) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL20127170 0.79 MAPT (0.40) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL20393956 0.79 CA1 (0.41) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL18819396 0.79 MEN1 (0.34) MEN1KMT2AKDM4ELMNAMAPT

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-2017074052-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2017-05-04 — — WO disclosed
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