SCHEMBL27169587

SCHEMBL27169587

Cc1cc(C)c2c(c1)C(C)(C)c1cc(Cl)ccc1-2

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.41
RAPGEF4 Q8WZA2 4/20 0.37
ADORA3 P0DMS8 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KCNK2 O95069 1/20 0.35
KCNK10 P57789 1/20 0.35
KCNK4 Q9NYG8 1/20 0.35
HSD11B1 P28845 1/20 0.34
PGR P06401 1/20 0.34
S100A4 P26447 1/20 0.33
CYP3A4 P08684 1/20 0.32
AKR1A1 P14550 1/20 0.32
AKR1B1 P15121 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32

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
SCHEMBL12377014 0.91 PDK2 (0.38) PDK2LMNASMN1; SMN2KCNK2KCNK10
SCHEMBL31363013 0.80 PDK2 (0.43) PDK2PGRCYP3A4AKR1A1AKR1B1
SCHEMBL31363096 0.80 PDK2 (0.41) PDK2RAPGEF4PGRS100A4
SCHEMBL1922755 0.78 PDK2 (0.52) PDK2LMNASMN1; SMN2KCNK2KCNK10
SCHEMBL16435207 0.77 PDK2 (0.42) PDK2LMNASMN1; SMN2HSD11B1PGR
SCHEMBL26569241 0.76 CRHR1 (0.37) PDK2SMN1; SMN2PGRAKR1A1AKR1B1
SCHEMBL17686479 0.76 PDK2 (0.43) PDK2PGR
SCHEMBL16435208 0.74 PDK2 (0.48) PDK2LMNASMN1; SMN2KCNK2KCNK10
SCHEMBL28560786 0.72 PDK2 (0.38) PDK2PGRAKR1A1AKR1B1
SCHEMBL30431586 0.72 PDK2 (0.38) PDK2PGRAKR1A1AKR1B1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240090320-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2024-03-14 US disclosed
CN-117586132-A Light-emitting element and amine compound for light-emitting element 三星显示有限公司 2024-02-23 CN disclosed