SCHEMBL22920775

SCHEMBL22920775

CC1(C)c2cc3ccc(Cl)cc3cc2-c2c1ccc1c2oc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AHR P35869 5/20 0.43
PGR P06401 1/20 0.40
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 7/20 0.34
MEN1 O00255 5/20 0.34
CYP2C19 P33261 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP2A6 P11509 1/20 0.33
POLB P06746 1/20 0.32
ALOX5 P09917 2/20 0.32
KDM4E B2RXH2 1/20 0.32
RXFP1 Q9HBX9 1/20 0.31
ALK Q9UM73 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
SCHEMBL16745229 0.88 AHR (0.49) AHRPGRLMNAMAPTKMT2A
SCHEMBL31135763 0.88 AHR (0.49) AHRPGRLMNAMAPTKMT2A
SCHEMBL30761898 0.87 AHR (0.48) AHRPGRLMNAMAPTKMT2A
SCHEMBL29523993 0.87 AHR (0.48) AHRPGRLMNAMAPTKMT2A
SCHEMBL4552248 0.87 AHR (0.48) AHRPGRLMNAMAPTKMT2A
SCHEMBL20927617 0.86 AHR (0.44) AHRPGRMAPTKMT2AMEN1
SCHEMBL12594456 0.84 PGR (0.50) AHRPGRMAPTKMT2AMEN1
SCHEMBL22920776 0.82 AHR (0.49) AHRPGRMAPTKMT2AMEN1
SCHEMBL19197497 0.77 PGR (0.33) PGRALK
SCHEMBL20205558 0.77 PGR (0.44) AHRPGRMAPTKMT2AMEN1

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-2021015555-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRIC ELEMENT 덕산네오룩스 주식회사 2021-01-28 WO disclosed