SCHEMBL22910220

SCHEMBL22910220

c1ccc(-c2nc(-c3ccc(-c4c(-c5ccccc5)ccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)nc(-c3cccnc3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.41
ALDH1A1 P00352 8/20 0.41
MAPT P10636 5/20 0.41
TSHR P16473 4/20 0.41
POLB P06746 2/20 0.41
SMN1; SMN2 Q16637 7/20 0.37
HPGD P15428 5/20 0.37
NPC1 O15118 4/20 0.37
KDM4E B2RXH2 4/20 0.37
TP53 P04637 4/20 0.37
HSD17B10 Q99714 4/20 0.37
RAB9A P51151 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C9 P11712 2/20 0.37
CLK4 Q9HAZ1 2/20 0.37
MEN1 O00255 1/20 0.37
GLA P06280 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL21351037 0.97 PDK2 (0.42) PDK2ALDH1A1MAPTTSHRPOLB
SCHEMBL22038385 0.91 PDK2 (0.48) PDK2ALDH1A1MAPTTSHRPOLB
SCHEMBL22910308 0.91 MEN1 (0.38) ALDH1A1MAPTTSHRPOLBSMN1; SMN2
SCHEMBL22910219 0.91 MEN1 (0.38) ALDH1A1MAPTTSHRPOLBSMN1; SMN2
SCHEMBL22910218 0.90 SMN1; SMN2 (0.39) PDK2ALDH1A1MAPTTSHRSMN1; SMN2
SCHEMBL22910370 0.89 PDK2 (0.39) PDK2ALDH1A1MAPTTSHRPOLB
SCHEMBL22910371 0.89 PDK2 (0.39) PDK2ALDH1A1MAPTTSHRPOLB
SCHEMBL22037459 0.88 PDK2 (0.48) PDK2ALDH1A1MAPTTSHRPOLB
SCHEMBL22038969 0.88 PDK2 (0.48) PDK2ALDH1A1MAPTTSHRPOLB
SCHEMBL20323363 0.87 PDK2 (0.46) PDK2ALDH1A1MAPTTSHRPOLB

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-11569453-B2 Polycyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2023-01-31 US disclosed
US-20210020848-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2021-01-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210020848-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME PPOX, NFE2L2, OGFOD1 PDK2 1174/4885ALDH1A1 830/4885MAPT 1709/4885
US-11569453-B2 Polycyclic compound and organic light emitting element comprising same PPOX, NFE2L2, OGFOD1 PDK2 1174/4885ALDH1A1 830/4885MAPT 1709/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.