SCHEMBL22921083

SCHEMBL22921083

CC(C)(C)c1cccnc1-c1cc(-n2c3ccccc3c3cc(C#N)ccc32)cc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.34
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
HRH1 P35367 1/20 0.33
HTR6 P50406 1/20 0.33
RORC P51449 2/20 0.32
SLC22A12 Q96S37 2/20 0.32
TRPV1 Q8NER1 1/20 0.32
CCNB2 O95067 1/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31
CCNA2 P20248 1/20 0.31
CDK2 P24941 1/20 0.31
GSK3A P49840 1/20 0.31
GSK3B P49841 1/20 0.31
CCNA1 P78396 1/20 0.31
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 1/20 0.31
CCNB3 Q8WWL7 1/20 0.31
AR P10275 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
SCHEMBL22921141 0.87 SMO (0.36) PTGER4DDB1CRBNHRH1HTR6
SCHEMBL22921136 0.83 PTGER4 (0.37) PTGER4DDB1CRBNHRH1HTR6
SCHEMBL22153679 0.77 RORC (0.35) PTGER4RORCSLC22A12
SCHEMBL21927855 0.76 TDO2 (0.39) PTGER4DDB1CRBNHRH1HTR6
SCHEMBL22921078 0.76 CYP2A6 (0.39) TRPV1NPC1
SCHEMBL22921111 0.76 CYP2A6 (0.39) TRPV1NPC1
SCHEMBL22153422 0.76 KDM4E (0.38) PTGER4RORC
SCHEMBL22153415 0.76 KDM4E (0.38) PTGER4RORC
SCHEMBL22153423 0.76 KDM4E (0.38) PTGER4RORC
SCHEMBL17721854 0.75 DDB1 (0.42) PTGER4DDB1CRBNHRH1HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11814374-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2023-11-14 US disclosed
US-11814374-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2023-11-14 US disclosed
US-20210024509-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2021-01-28 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-11814374-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same OCIAD1, OCIAD2, AOX1 PTGER4 1771/4885DDB1 1392/4885CRBN 4443/4885
US-20210024509-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME OCIAD1, OCIAD2, AOX1 PTGER4 1771/4885DDB1 1392/4885CRBN 4443/4885

“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.