SCHEMBL23637491

SCHEMBL23637491

Clc1cc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc2c1sc1cc3ccccc3cc12

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
OPRK1 P41145 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
DHFR P00374 1/20 0.30
TYMS P04818 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
SCHEMBL23637487 0.86 KDM4E (0.36) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL23637498 0.83 CYP1A1 (0.34) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL23637312 0.80 DHFR (0.34) MAPTDHFRTYMS
SCHEMBL23637365 0.80 KDM4E (0.31) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL23637492 0.77 CYP1A1 (0.43) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL23637435 0.73 ALOX5 (0.38) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL20348960 0.73 KDM4E (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL24466718 0.72 MEN1 (0.36) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL20349026 0.72
SCHEMBL23637503 0.72 MAPT (0.37) KDM4EMEN1LMNAMAPTOPRK1

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