SCHEMBL17084907

SCHEMBL17084907

Cc1cc2ccccc2c2nc3cc4c(cc3n12)C(C)(C)CC4(C)C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.38
HSD17B10 Q99714 4/20 0.38
MAPT P10636 4/20 0.38
LMNA P02545 3/20 0.38
POLB P06746 2/20 0.38
TP53 P04637 1/20 0.38
IKBKB O14920 5/20 0.37
CHUK O15111 5/20 0.37
ALDH1A1 P00352 9/20 0.34
HPGD P15428 4/20 0.34
TSHR P16473 2/20 0.34
GAA P10253 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CASP1 P29466 1/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
AHR P35869 1/20 0.32

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
SCHEMBL15427877 0.87 KDM4E (0.38) KDM4EHSD17B10MAPTLMNAPOLB
SCHEMBL15428046 0.86 KDM4E (0.37) KDM4EHSD17B10MAPTLMNAPOLB
SCHEMBL15428181 0.79 PRKDC (0.40) KDM4EHSD17B10MAPTLMNATP53
SCHEMBL12145479 0.77 KDM4E (0.61) KDM4EHSD17B10MAPTLMNAPOLB
SCHEMBL15428206 0.77
SCHEMBL12145495 0.76 IKBKB (0.48) KDM4EHSD17B10MAPTLMNAPOLB
SCHEMBL15428183 0.76 ALDH1A1 (0.47) KDM4EHSD17B10MAPTLMNAPOLB
SCHEMBL15428205 0.75 KDM4E (0.34) KDM4EHSD17B10MAPTLMNAPOLB
SCHEMBL19670853 0.75 KDM4E (0.38) KDM4EHSD17B10MAPTLMNAPOLB
SCHEMBL15427890 0.73

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
US-9837622-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-05 US disclosed
US-9837622-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-05 US disclosed
US-20150263297-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-09-17 US disclosed
US-20150263297-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-09-17 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-20150263297-A1 Metal Complexes SOD1, AP1M1, AP3M1 KDM4E 3816/4885HSD17B10 2888/4885MAPT 1084/4885

“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.