SCHEMBL22328872

SCHEMBL22328872

Cc1ccccc1-c1c2ccccc2c2c3ccccc3c3c4c(cc1c23)c1ccc2c3ccc5c6c(ccc(c7ccc4c1c27)c63)-c1c-5c(-c2cccc3c2sc2ccccc23)c2ccccc2c1-c1cccc2c1sc1ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 6/20 0.38
ALOX5 P09917 1/20 0.38
PARP14 Q460N5 1/20 0.36
MAPT P10636 2/20 0.32
SLC9A1 P19634 2/20 0.31
L3MBTL1 Q9Y468 3/20 0.30
ALDH1A1 P00352 2/20 0.30
HCRTR1 O43613 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
PIK3CD O00329 1/20 0.30
BRD4 O60885 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
MTOR P42345 1/20 0.30
PIK3CG P48736 1/20 0.30
KCNH2 Q12809 1/20 0.30
BRDT Q58F21 1/20 0.30
ATM Q13315 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL22727651 0.85 PARP14 (0.37) PRKDCALOX5PARP14MAPTSLC9A1
SCHEMBL16372516 0.79 PARP14 (0.37) PRKDCALOX5PARP14MAPTSLC9A1
SCHEMBL21888346 0.78 PARP14 (0.36) PRKDCALOX5PARP14MAPTSLC9A1
SCHEMBL21851616 0.77 ALOX5 (0.42) PRKDCALOX5PARP14MAPTL3MBTL1
SCHEMBL23347064 0.76 PARP14 (0.39) PRKDCALOX5PARP14MAPTSLC9A1
SCHEMBL21888312 0.76 PARP14 (0.35) PRKDCALOX5PARP14MAPTSLC9A1
SCHEMBL10081413 0.74 PARP14 (0.44) PRKDCALOX5PARP14MAPTSLC9A1
SCHEMBL22328879 0.74 PIM1 (0.30)
SCHEMBL12011482 0.74 ALOX5 (0.49) PRKDCALOX5PARP14MAPTL3MBTL1
SCHEMBL23427866 0.73 ALOX5 (0.50) PRKDCALOX5PARP14MAPTPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200255358-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2020-08-13 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-20200255358-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CCNL2, MCM4, CCNT1 PRKDC 4856/4885ALOX5 2531/4885PARP14 3039/4885

“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.