SCHEMBL12116339

SCHEMBL12116339

Cn1c2ccccc2c2cc3c(cc21)-c1ccc(-n2c4ccccc4c4ccc(-c5ccccc5)cc42)cc1C3(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.46
▸ RXRB P28702 1/20 0.46
▸ KDM4E B2RXH2 5/20 0.36
▸ HPGD P15428 4/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MAOB P27338 1/20 0.35
▸ L3MBTL1 Q9Y468 4/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ RAB9A P51151 3/20 0.35
▸ GPR3 P46089 1/20 0.34
▸ KIF11 P52732 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ LIMK1 P53667 1/20 0.33
▸ MAPT P10636 3/20 0.33
▸ ATM Q13315 2/20 0.33
▸ HDAC4 P56524 1/20 0.32
▸ LMNA P02545 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
SCHEMBL12116368 0.92 L3MBTL1 (0.41) RXRARXRBKDM4EALDH1A1MAOB
SCHEMBL12116365 0.92 L3MBTL1 (0.41) RXRARXRBKDM4EALDH1A1MAOB
SCHEMBL12116351 0.90 GPR3 (0.42) RXRARXRBKDM4EHPGDHSD17B10
SCHEMBL13309435 0.90 KDM4E (0.40) RXRARXRBKDM4EHSD17B10MAOB
SCHEMBL2609897 0.89 L3MBTL1 (0.42) RXRARXRBKDM4EALDH1A1L3MBTL1
SCHEMBL12647527 0.88 L3MBTL1 (0.41) RXRARXRBKDM4EHSD17B10ALDH1A1
SCHEMBL12116341 0.88 RXRA (0.39) RXRARXRBKDM4EHPGDHSD17B10
SCHEMBL24569000 0.87 RXRA (0.38) RXRARXRBKDM4EHSD17B10MAOB
SCHEMBL2609898 0.87 L3MBTL1 (0.44) RXRARXRBKDM4EALDH1A1L3MBTL1
SCHEMBL2609877 0.86 PDK2 (0.35) RXRARXRBKDM4EMAOBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110272685-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2011-11-10 — — US disclosed
US-20110272685-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2011-11-10 — — US disclosed
WO-2010083873-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2010-07-29 — — 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-20110272685-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES SLCO4C1, SLCO2A1, SLCO2B1 RXRA 4517/4885RXRB 4494/4885KDM4E 3857/4885

“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.

Send feedback