SCHEMBL18463294

SCHEMBL18463294

CC1(C)c2ccccc2-c2c(-c3nc(-c4ccc5ccccc5c4)nc(-c4ccc5ccccc5c4)n3)cccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
PTGER3 P43115 4/20 0.36
GSTP1 P09211 1/20 0.36
LPL P06858 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
HSD17B1 P14061 1/20 0.34
HSD17B2 P37059 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
IKBKB O14920 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
PDK2 Q15119 2/20 0.34
AURKA O14965 1/20 0.34
AURKB Q96GD4 1/20 0.34
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL18386141 0.95 ALDH1A1 (0.37) HDAC4HDAC2HDAC8PTGER3GSTP1
SCHEMBL22058515 0.94 HDAC4 (0.40) HDAC4HDAC2HDAC8PTGER3GSTP1
SCHEMBL18386128 0.93 HDAC4 (0.39) HDAC4HDAC2HDAC8PTGER3GSTP1
SCHEMBL24122798 0.92 MEN1 (0.39) HDAC4HDAC2HDAC8PTGER3LPL
SCHEMBL18463296 0.92 MEN1 (0.36) HDAC4HDAC2HDAC8PTGER3HSD17B1
SCHEMBL17151643 0.92 PIM1 (0.36) HDAC4HDAC2HDAC8PTGER3GSTP1
SCHEMBL18464287 0.92 HDAC4 (0.35) HDAC4HDAC2HDAC8PTGER3GSTP1
SCHEMBL19271436 0.92 LPL (0.35) HDAC4HDAC2HDAC8PTGER3LPL
SCHEMBL18386107 0.92 PIM1 (0.34) HDAC4HDAC2HDAC8PTGER3GSTP1
SCHEMBL17151851 0.91 PIM1 (0.36) HDAC4HDAC2HDAC8PTGER3GSTP1

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-20210050528-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2021-02-18 US disclosed
US-20180222872-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-08-09 US disclosed
US-20180222872-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-08-09 US disclosed
WO-2017016630-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-02-02 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-20180222872-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES PIEZO1, NES, PIR HDAC4 3060/4885HDAC2 2296/4885HDAC8 3203/4885

“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.