SCHEMBL15829296

SCHEMBL15829296

CC(C)(C)c1ccc2c(ccn3c4nc(C(C)(C)C)ccc4c(=O)nc23)n1

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
POLB P06746 2/20 0.31
TP53 P04637 2/20 0.31
RAB9A P51151 2/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 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
SCHEMBL15841046 0.85
SCHEMBL16175948 0.84 ALDH1A1 (0.40) HSD17B10KDM4EHPGDTP53RAB9A
SCHEMBL15829529 0.83 MAPT (0.44) HSD17B10KDM4EHPGDTP53RAB9A
SCHEMBL15841049 0.80 CYP1A2 (0.32) HSD17B10KDM4EALDH1A1
SCHEMBL15841047 0.80 USP2 (0.30)
SCHEMBL15841025 0.79 ALDH1A1 (0.40) HSD17B10KDM4EPOLBTP53RAB9A
SCHEMBL15841037 0.79 ALDH1A1 (0.32) HSD17B10TP53RAB9AALDH1A1LMNA
SCHEMBL15841097 0.79
SCHEMBL15841085 0.79
SCHEMBL15841084 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2935293-B1 IRIDIUM COMPLEXES AND THEIR USE IN ELECTRONIC DEVICES, ESPECIALLY ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-08-21 EP disclosed
US-20150318498-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-11-05 US disclosed
US-20150318498-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-11-05 US disclosed
WO-2014094962-A2 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 (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-20150318498-A1 Metal Complexes SOD1, AP1M1, AP3M1 HSD17B10 2888/4885KDM4E 3816/4885HPGD 3882/4885

“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.