SCHEMBL15840934

SCHEMBL15840934

CC1(C)CC(C)(C)c2c1c(=O)nc1c3ccccc3ccn21

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 9/20 0.43
PARP1 P09874 1/20 0.41
MTOR P42345 1/20 0.40
MAPT P10636 4/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPK1 P28482 2/20 0.38
HCRTR1 O43613 1/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 6/20 0.37
KMT2A Q03164 2/20 0.37
RXFP1 Q9HBX9 1/20 0.37
NPC1 O15118 1/20 0.37
HSD17B10 Q99714 1/20 0.36
HTR6 P50406 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL15840895 0.84 KMT2A (0.34) PRKDCMAPTALDH1A1KDM4EKMT2A
SCHEMBL19794407 0.83 PRKDC (0.33) PRKDCMTORMAPTALDH1A1
SCHEMBL21289807 0.83 PRKDC (0.31) PRKDCALDH1A1
SCHEMBL15840892 0.82 KDM4E (0.31) ALDH1A1KDM4E
SCHEMBL23956214 0.80 PRKDC (0.32) PRKDC
SCHEMBL15840994 0.80 PRKDC (0.34) PRKDCPARP1MTOR
SCHEMBL15840956 0.79 PRKDC (0.42) PRKDCPARP1MTORMAPTRAB9A
SCHEMBL23956299 0.79 PRKDC (0.31) PRKDC
SCHEMBL18015474 0.77 PRMT5 (0.33) PRKDC
SCHEMBL21202813 0.77 PRKDC (0.30) PRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220209141-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2022-06-30 US disclosed
US-11024815-B2 Metal complexes MERCK PATENT GMBH (DE) 2021-06-01 US disclosed
WO-2020212296-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2020-10-22 WO disclosed
EP-2935291-B1 IRIDIUM COMPLEXES USED IN OLIGOMERS, POLYMERS OR DENDRIMERS IN ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-10-16 EP disclosed
EP-3254317-B1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2019-07-31 EP disclosed
EP-3328872-B1 ELECTROLUMINESCENT BRIDGED METAL COMPLEXES FOR USE IN ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-05-29 EP disclosed
US-20180226591-A1 ELECTROLUMINESCENT BRIDGED METAL COMPLEXES FOR USE IN ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-08-09 US disclosed
US-20180226591-A1 ELECTROLUMINESCENT BRIDGED METAL COMPLEXES FOR USE IN ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-08-09 US disclosed
US-20180026209-A1 Metal Complexes MERCK PATENT GMBH (DE) 2018-01-25 US disclosed
US-20180026209-A1 Metal Complexes MERCK PATENT GMBH (DE) 2018-01-25 US disclosed
WO-2017016634-A1 ELECTROLUMINESCENT BRIDGED METAL COMPLEXES FOR USE IN ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-02-02 WO disclosed
WO-2016124304-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2016-08-11 WO disclosed
US-20150349277-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2015-12-03 US disclosed
US-20150349277-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2015-12-03 US disclosed
WO-2014094960-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2014-06-26 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 (5 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-20150349277-A1 METAL COMPLEXES SOD1, AP1M1, AP3M1 PRKDC 3860/4885PARP1 1422/4885MTOR 4584/4885
US-11024815-B2 Metal complexes EXOC4, EXOC3, TIMCC PRKDC 2721/4885PARP1 318/4885MTOR 4657/4885
US-20220209141-A1 METAL COMPLEXES AP1M1, SOD1, AP3M1 PRKDC 3917/4885PARP1 1216/4885MTOR 4628/4885
US-20180026209-A1 Metal Complexes AP3M1, AP2M1, SOD1 PRKDC 3329/4885PARP1 1151/4885MTOR 4597/4885
US-20180226591-A1 ELECTROLUMINESCENT BRIDGED METAL COMPLEXES FOR USE IN ELECTRONIC DEVICES EED, SOD1, NBAS PRKDC 4246/4885PARP1 1562/4885MTOR 4614/4885

“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.