SCHEMBL23637442

SCHEMBL23637442

Clc1cc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc2oc3ccccc3c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 6/20 0.40
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 1/20 0.37
OPRK1 P41145 1/20 0.37
WEE1 P30291 1/20 0.34
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
MAOA P21397 2/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL23637357 0.86 AHR (0.39) AHRMEN1KMT2AKDM4EMAPT
SCHEMBL23637433 0.85 TNKS (0.38) AHRMEN1KMT2AKDM4EMAPT
SCHEMBL26574532 0.85 AHR (0.35) AHRMEN1KMT2AKDM4EMAPT
SCHEMBL23637485 0.83 AHR (0.46) AHRMEN1KMT2AKDM4EMAPT
SCHEMBL23637451 0.83 AHR (0.42) AHRMEN1KMT2AKDM4EMAPT
SCHEMBL27389917 0.82 AHR (0.35) AHRMEN1KMT2AKDM4EMAPT
SCHEMBL23098629 0.81 MEN1 (0.33) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL23637427 0.81 NPC1 (0.36)
SCHEMBL21975171 0.80 MEN1 (0.45) AHRMEN1KMT2AKDM4EMAPT
SCHEMBL29276498 0.80 SMN1; SMN2 (0.40) AHRMEN1KMT2AKDM4EMAPT

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-2021141356-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-07-15 WO disclosed