SCHEMBL23637422

SCHEMBL23637422

Clc1ccccc1-c1cc(C2(c3ccccc3)c3ccccc3-c3ccccc32)c2sc3ccccc3c2c1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.36
PRSS12 P56730 1/20 0.35
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
ALOX5 P09917 1/20 0.34
CYP2A6 P11509 1/20 0.34
MAPT P10636 2/20 0.34
SLC9A1 P19634 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
OPRK1 P41145 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP1A1 P04798 1/20 0.30
CYP1B1 Q16678 1/20 0.30
GPR3 P46089 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
SCHEMBL23637435 0.86 ALOX5 (0.38) PDK2PRSS12TNKSTNKS2ALOX5
SCHEMBL23637500 0.85 KDM4E (0.35) PDK2TNKSTNKS2ALOX5MAPT
SCHEMBL23637487 0.83 KDM4E (0.36) TNKSTNKS2ALOX5MAPTKDM4E
SCHEMBL437570 0.79 ALOX5 (0.42) TNKSTNKS2ALOX5MAPTKDM4E
SCHEMBL328569 0.79 LIMK1 (0.40) PDK2TNKSTNKS2ALOX5MAPT
SCHEMBL438594 0.76 PARP14 (0.46) TNKSTNKS2ALOX5MAPTKDM4E
SCHEMBL440562 0.75 PARP14 (0.45) TNKSTNKS2ALOX5MAPTKDM4E
SCHEMBL23637420 0.75
SCHEMBL24279307 0.75 ALOX5 (0.37) PDK2TNKSTNKS2ALOX5
SCHEMBL18086197 0.74 ALOX5 (0.54) PDK2TNKSTNKS2ALOX5MAPT

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