SCHEMBL20198527

SCHEMBL20198527

C=C/C=C(\C=C)c1ccc(N(c2ccccc2)c2ccc(C3(c4ccccc4)c4ccccc4-c4ccccc43)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ OPRK1 P41145 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ POLB P06746 1/20 0.36
▸ ESR1 P03372 1/20 0.33
▸ ESR2 Q92731 1/20 0.33

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
SCHEMBL22902194 0.87 PDK2 (0.35) —
SCHEMBL22902164 0.83 MEN1 (0.34) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL19867937 0.83 ALDH1A1 (0.39) MEN1KMT2AKDM4EMAPTPOLB
SCHEMBL19101646 0.82 MEN1 (0.32) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL12861391 0.80 MEN1 (0.55) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL12978426 0.80 MEN1 (0.55) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL6128461 0.79 MEN1 (0.39) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL30534896 0.78 MEN1 (0.57) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL30561153 0.78 MEN1 (0.57) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL398497 0.78 MEN1 (0.57) 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
EP-2496591-B1 ORGANOMETALLIC COMPLEX, LIGHT-EMITTING ELEMENT, DISPLAY DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2018-05-30 — — EP disclosed
Send feedback