SCHEMBL26536459

SCHEMBL26536459

CC(C)(C)c1cc(-c2ccc(-c3cccc4sc5ccccc5c34)c([N+](=O)[O-])c2)cc(C(C)(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
MAPT P10636 2/20 0.34
RXRB P28702 3/20 0.33
EIF4E P06730 2/20 0.33
RXRA P19793 2/20 0.33
BRDT Q58F21 1/20 0.33
ERN1 O75460 1/20 0.33
POLB P06746 1/20 0.32
AHR P35869 1/20 0.32
THRB P10828 1/20 0.32
S1PR1 P21453 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
TNKS O95271 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP3 P42574 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
SCHEMBL26536378 0.87 ALOX5 (0.41) MEN1KMT2AMAPTRXRBEIF4E
SCHEMBL26536499 0.85 CRHBP (0.41) MEN1KMT2AMAPTEIF4EBRDT
SCHEMBL26536458 0.82 RXRB (0.39) MEN1KMT2AMAPTRXRBRXRA
SCHEMBL26270526 0.79 RXRB (0.40) MAPTRXRBRXRABRDTTNKS
SCHEMBL16218709 0.77 TDP1 (0.47) MEN1KMT2AMAPTBRDTNPC1
SCHEMBL26536453 0.77 S100A4 (0.40) MEN1KMT2AEIF4EBRDTPOLB
SCHEMBL26536479 0.77 ALDH1A1 (0.42) MEN1KMT2AEIF4EBRDTERN1
SCHEMBL26050738 0.76 GPR3 (0.38) MEN1KMT2AMAPTRXRBRXRA
SCHEMBL21971532 0.76 BRDT (0.35) RXRBRXRABRDTTNKSTNKS2
SCHEMBL26050728 0.76 RXRA (0.40) MAPTRXRBRXRABRDTALDH1A1

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-20230322802-A1 LIGHT EMITTING DEVICE AND FUSED POLYCYCLIC COMPOUND FOR THE LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-12 US disclosed
US-20230322802-A1 LIGHT EMITTING DEVICE AND FUSED POLYCYCLIC COMPOUND FOR THE LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-12 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 (1 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-20230322802-A1 LIGHT EMITTING DEVICE AND FUSED POLYCYCLIC COMPOUND FOR THE LIGHT EMITTING DEVICE CRY1, LAGE3, CRY2 MEN1 618/4885KMT2A 828/4885MAPT 2225/4885

“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.