SCHEMBL23637361

SCHEMBL23637361

Fc1ccc2c(c1)-c1ccccc1C2(c1ccccc1)c1cc(Cl)cc2oc3ccccc3c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.37
AHR P35869 4/20 0.35
WEE1 P30291 1/20 0.31
GABRP O00591 3/20 0.31
GABRD O14764 3/20 0.31
GABRA1 P14867 3/20 0.31
GABRB1 P18505 3/20 0.31
GABRG2 P18507 3/20 0.31
GABRB3 P28472 3/20 0.31
GABRA5 P31644 3/20 0.31
GABRA3 P34903 3/20 0.31
GABRA2 P47869 3/20 0.31
GABRB2 P47870 3/20 0.31
GABRA4 P48169 3/20 0.31
GABRE P78334 3/20 0.31
GABRA6 Q16445 3/20 0.31
GABRG1 Q8N1C3 3/20 0.31
GABRG3 Q99928 3/20 0.31
GABRQ Q9UN88 3/20 0.31
TNKS O95271 2/20 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
SCHEMBL23637451 0.91 AHR (0.42) PDK2AHRWEE1GABRPGABRD
SCHEMBL23637486 0.83 AHR (0.35) AHRWEE1KDM4EMEN1MAPT
SCHEMBL24279298 0.82 AHR (0.43) PDK2AHRGABRPGABRDGABRA1
SCHEMBL29276498 0.77 SMN1; SMN2 (0.40) AHRGABRPGABRDGABRA1GABRB1
SCHEMBL23098691 0.77 AHR (0.49) PDK2AHRGABRPGABRDGABRA1
SCHEMBL23637442 0.75 AHR (0.40) AHRWEE1KDM4EMEN1LMNA
SCHEMBL23637357 0.75 AHR (0.39) PDK2AHRWEE1GABRPGABRD
SCHEMBL23098749 0.74 AHR (0.46) PDK2AHRWEE1GABRPGABRD
SCHEMBL25954077 0.74 PDK2 (0.57) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL23096710 0.74 KDM4E (0.31) 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