SCHEMBL25567792

SCHEMBL25567792

Clc1cccc2c1oc1cc(-c3cccc(C4=CCCC=C4c4ccccc4)c3)ccc12

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TTR P02766 4/20 0.41
AHR P35869 7/20 0.40
PRKDC P78527 2/20 0.34
ALOX5 P09917 1/20 0.33
PIM1 P11309 1/20 0.33
CSNK2A2 P19784 1/20 0.33
CSNK2B P67870 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
DYRK1A Q13627 1/20 0.33
PLA2G2A P14555 2/20 0.32
PLA2G4A P47712 2/20 0.32
PLA2G10 O15496 1/20 0.32
SMO Q99835 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
SCHEMBL29693288 0.85 TTR (0.49) TTRAHRPRKDCALOX5PIM1
SCHEMBL24969295 0.85 TTR (0.49) TTRAHRPRKDCALOX5PIM1
SCHEMBL22129987 0.80 AHR (0.54) TTRAHRPRKDCALOX5DYRK1A
SCHEMBL25567683 0.79 ALOX5 (0.47) TTRAHRPRKDCALOX5PIM1
SCHEMBL23765006 0.79 AHR (0.45) TTRAHRALOX5
SCHEMBL26779585 0.76 TTR (0.47) TTRAHRALOX5PIM1CSNK2A2
SCHEMBL23824076 0.75 TTR (0.46) TTRAHRALOX5PIM1CSNK2A2
SCHEMBL1637813 0.74 PLA2G2A (0.42) PRKDCALOX5DYRK1APLA2G2APLA2G4A
SCHEMBL21926366 0.74 AHR (0.45) TTRAHRALOX5PIM1CSNK2A2
SCHEMBL21191839 0.74 TTR (0.43) TTRAHRPRKDCALOX5PIM1

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-2023096209-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-06-01 WO disclosed