SCHEMBL14096679

SCHEMBL14096679

Cc1cc2c3c(c4c(c2cc1C)-c1ccc(C(=O)c2ccccc2)cc1C41c2ccccc2-c2ccccc21)C1(c2ccccc2-c2ccccc21)c1cc(C(=O)c2ccccc2)ccc1-3

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.50
▸ CNR2 P34972 1/20 0.42
▸ ATM Q13315 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ LMNA P02545 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ MITF O75030 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ ESR2 Q92731 1/20 0.38
▸ HTR7 P34969 1/20 0.37
▸ HTR2B P41595 1/20 0.37
▸ BCL2L1 Q07817 1/20 0.37
▸ PBRM1 Q86U86 1/20 0.36
▸ PTPRC P08575 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ ELANE P08246 1/20 0.35
▸ CES2 O00748 1/20 0.35
▸ CES1 P23141 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
SCHEMBL19292407 0.90 PDK2 (0.42) PDK2CNR2ATMTDP1L3MBTL1
SCHEMBL14096680 0.88 ALDH1A1 (0.40) PDK2CNR2L3MBTL1POLBESR1
SCHEMBL13423231 0.86 PDK2 (0.56) PDK2CNR2ATMTDP1L3MBTL1
SCHEMBL13423252 0.86 PDK2 (0.58) PDK2CNR2ATMTDP1L3MBTL1
SCHEMBL13423257 0.86 PDK2 (0.58) PDK2CNR2ATMTDP1L3MBTL1
SCHEMBL13423232 0.86 PDK2 (0.58) PDK2CNR2ATMTDP1L3MBTL1
SCHEMBL14096678 0.85 BCL2L1 (0.42) PDK2CNR2NPC1ESR1ESR2
SCHEMBL13423246 0.84 PDK2 (0.57) PDK2CNR2ATMTDP1L3MBTL1
SCHEMBL133477 0.81 PDK2 (0.66) PDK2CNR2ATMTDP1L3MBTL1
SCHEMBL1552743 0.81 PDK2 (0.66) PDK2CNR2ATMTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3211058-B1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-08-23 — — EP disclosed
EP-3211058-A1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2017-08-30 — — EP disclosed
US-8748010-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-06-10 — — US disclosed
US-8748010-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-06-10 — — US disclosed
US-20080193797-A1 Novel Materials for Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-08-14 — — US disclosed
US-20080193797-A1 Novel Materials for Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-08-14 — — 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-20080193797-A1 Novel Materials for Organic Electroluminescent Devices SLC40A1, SLC67A1, SLC29A1 PDK2 2432/4885CNR2 3910/4885ATM 4138/4885

“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.

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