SCHEMBL18212111

SCHEMBL18212111

c1ccc(-c2cccc(-c3ccccc3Nc3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 6/20 0.39
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ SIRT2 Q8IXJ6 1/20 0.36
▸ SIRT1 Q96EB6 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ AKR1C3 P42330 1/20 0.33
▸ FABP3 P05413 1/20 0.32
▸ FABP4 P15090 1/20 0.32
▸ FABP5 Q01469 1/20 0.32
▸ ESR1 P03372 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ SYK P43405 1/20 0.31
▸ AURKA O14965 1/20 0.31
▸ PTGER1 P34995 1/20 0.30

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
SCHEMBL22662325 0.94 PDK2 (0.39) PDK2MEN1KMT2APOLBSIRT2
SCHEMBL18212129 0.92 PDK2 (0.40) PDK2MEN1KMT2APOLBSIRT2
SCHEMBL16926140 0.92 PDK2 (0.42) PDK2MEN1KMT2APOLBKDM4E
SCHEMBL30353956 0.92 PDK2 (0.42) PDK2MEN1KMT2APOLBKDM4E
SCHEMBL22662297 0.88 MEN1 (0.40) PDK2MEN1KMT2APOLBKDM4E
SCHEMBL18212136 0.88 PDK2 (0.39) PDK2MEN1KMT2APOLBSIRT2
SCHEMBL22662302 0.88 PDK2 (0.41) PDK2MEN1KMT2APOLBKDM4E
SCHEMBL17194800 0.88 PDK2 (0.47) PDK2MEN1KMT2APOLBKDM4E
SCHEMBL31245654 0.87 PDK2 (0.41) PDK2MEN1KMT2APOLBKDM4E
SCHEMBL22662370 0.87 PDK2 (0.40) PDK2MEN1KMT2APOLBSIRT2

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-3101016-B1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO (JP) 2023-11-29 — — EP disclosed
WO-2021045590-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2021-03-11 — — WO disclosed
US-10840455-B1 Compound for organic electronic element, organic electronic element using the same, and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2020-11-17 — — US disclosed
US-20190259948-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO., LTD. (JP) 2019-08-22 — — US disclosed
EP-3101016-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC APPARATUS Idemitsu Kosan Co., Ltd (JP) 2016-12-07 — — EP disclosed
US-20160329492-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO., LTD. (JP) 2016-11-10 — — 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 (3 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-20160329492-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC APPARATUS PIEZO1, RER1, ESR2 PDK2 2128/4885MEN1 493/4885KMT2A 1336/4885
US-20190259948-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC APPARATUS PIEZO1, RER1, ESR2 PDK2 2128/4885MEN1 493/4885KMT2A 1336/4885
US-10840455-B1 Compound for organic electronic element, organic electronic element using the same, and electronic device thereof ETV6, OR51E2, ESR1 PDK2 3141/4885MEN1 1214/4885KMT2A 497/4885

“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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