SCHEMBL22078271

SCHEMBL22078271

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)oc3c4ccc4c5cccc(-n6c7ccccc7c7ccccc76)c5oc43)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.34
TSHR P16473 4/20 0.33
ALDH1A1 P00352 8/20 0.33
MAPT P10636 8/20 0.32
ALOX5 P09917 1/20 0.32
MEN1 O00255 5/20 0.31
KMT2A Q03164 5/20 0.31
HPGD P15428 4/20 0.31
KDM4E B2RXH2 5/20 0.31
LMNA P02545 3/20 0.31
MAPK1 P28482 3/20 0.31
HSD17B10 Q99714 3/20 0.31
POLB P06746 1/20 0.31
ATM Q13315 2/20 0.31
TP53 P04637 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL21668670 0.98 PRKDC (0.35) PRKDCTSHRALDH1A1MAPTALOX5
SCHEMBL21668711 0.96 PRKDC (0.35) PRKDCTSHRALDH1A1MAPTALOX5
SCHEMBL25926470 0.96 PRKDC (0.35) PRKDCTSHRALDH1A1MAPTALOX5
SCHEMBL25494345 0.96 PRKDC (0.35) PRKDCTSHRALDH1A1MAPTALOX5
SCHEMBL21669076 0.95 PRKDC (0.34) PRKDCTSHRALDH1A1MAPTALOX5
SCHEMBL21192018 0.95 PRKDC (0.39) PRKDCTSHRALDH1A1MAPTALOX5
SCHEMBL21573667 0.95 PRKDC (0.34) PRKDCTSHRALDH1A1MAPTALOX5
SCHEMBL25926436 0.94 PRKDC (0.39) PRKDCTSHRALDH1A1MAPTALOX5
SCHEMBL24216179 0.94 PRKDC (0.34) PRKDCTSHRALDH1A1MAPTALOX5
SCHEMBL21668713 0.94 PRKDC (0.34) PRKDCTSHRALDH1A1MAPTALOX5

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-20220056048-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2022-02-24 US disclosed
WO-2020116800-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2020-06-11 WO 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-20220056048-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY1, CRY2, ARRB1 PRKDC 4780/4885TSHR 1743/4885ALDH1A1 1293/4885

“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.