SCHEMBL20435731

SCHEMBL20435731

COc1ccc2nc(C(F)(F)F)c(C#N)c(N3CCN(C)CC3)c2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCC8 Q09428 1/20 0.62
▸ KCNJ11 Q14654 1/20 0.62
▸ KMT2A Q03164 4/20 0.52
▸ KDM4E B2RXH2 4/20 0.52
▸ MAPT P10636 3/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ CDK2 P24941 1/20 0.52
▸ CLK1 P49759 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ LMNA P02545 4/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ HTT P42858 2/20 0.48
▸ DNMT1 P26358 1/20 0.45
▸ RAD52 P43351 1/20 0.45
▸ POLB P06746 1/20 0.43
▸ NCOA1 Q15788 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ NCOA3 Q9Y6Q9 1/20 0.43
▸ ACHE P22303 1/20 0.43

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
SCHEMBL2090089 0.77 ABCC8 (1.00) ABCC8KCNJ11KMT2AKDM4EMAPT
SCHEMBL20440779 0.76 SCN9A (0.47) ABCC8KCNJ11KMT2AKDM4EMAPT
SCHEMBL6125250 0.73 ADRB2 (0.72) KMT2AKDM4EMAPTMEN1ALDH1A1
SCHEMBL13135654 0.73 EZH2 (0.55) KMT2AKDM4EMAPTMEN1ALDH1A1
SCHEMBL20435733 0.72 PIK3CA (0.51) ABCC8KCNJ11KMT2AKDM4EMEN1
SCHEMBL25758141 0.70 MEN1 (0.56) KMT2AKDM4EMEN1DNMT1RAD52
SCHEMBL20435734 0.69 ABCC8 (0.60) ABCC8KCNJ11KMT2AKDM4EMAPT
SCHEMBL13174790 0.68 EZH2 (0.55) KMT2AKDM4EMAPTMEN1ALDH1A1
SCHEMBL12068386 0.68 KDM4E (0.69) ABCC8KCNJ11KMT2AKDM4EMAPT
SCHEMBL20435728 0.67 ABCC8 (0.58) ABCC8KCNJ11KMT2AKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11377442-B2 Small molecule agonists and antagonists of NR2F6 activity Zander Biologics, Inc (US) 2022-07-05 — — US disclosed
US-11324719-B2 Small molecule agonists and antagonists of NR2F6 activity in humans KCL THERAPEUTICS, INC. (US) 2022-05-10 — — US disclosed
US-20200071307-A1 SMALL MOLECULE AGONISTS AND ANTAGONISTS OF NR2F6 ACTIVITY IN ANIMALS Zander Therapeutics, Inc. (US) 2020-03-05 — — US disclosed
US-10472351-B2 Small molecule agonists and antagonists of NR2F6 activity in animals Zander Therapeutics, Inc. (US) 2019-11-12 — — US disclosed
WO-2019104201-A1 SMALL MOLECULE AGONISTS AND ANTAGONISTS OF NR2F6 ACTIVITY IN NON-HUMANS Zander Therapeutics, Inc. (US) 2019-05-31 — — WO disclosed
WO-2019104199-A1 SMALL MOLECULE AGONISTS AND ANTAGONISTS OF NR2F6 ACTIVITY REGEN BIOPHARMA INC. (US) 2019-05-31 — — WO disclosed
US-20190054118-A1 Small Molecule Agonists and Antagonists of NR2F6 Activity in Animals Zander Therapeutics, Inc. 2019-02-21 — — US disclosed
US-20180214413-A1 Small Molecule Agonists and Antagonists of NR2F6 Activity in Humans KCL THERAPEUTICS, INC 2018-08-02 — — US disclosed
US-20180214413-A1 Small Molecule Agonists and Antagonists of NR2F6 Activity in Humans KCL THERAPEUTICS, INC 2018-08-02 — — 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 (6 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-20180214413-A1 Small Molecule Agonists and Antagonists of NR2F6 Activity in Humans NR4A2, NR2C2, NR0B2 ABCC8 1987/4885KCNJ11 4734/4885KMT2A 999/4885
US-20200071307-A1 SMALL MOLECULE AGONISTS AND ANTAGONISTS OF NR2F6 ACTIVITY IN ANIMALS NR4A2, NR2C2, NR0B2 ABCC8 2042/4885KCNJ11 4724/4885KMT2A 904/4885
US-20190054118-A1 Small Molecule Agonists and Antagonists of NR2F6 Activity in Animals NR4A2, NR2C2, NR0B2 ABCC8 2042/4885KCNJ11 4724/4885KMT2A 904/4885
US-11324719-B2 Small molecule agonists and antagonists of NR2F6 activity in humans NR4A2, NR2C2, NR0B2 ABCC8 1987/4885KCNJ11 4734/4885KMT2A 999/4885
US-11377442-B2 Small molecule agonists and antagonists of NR2F6 activity NR4A2, NR2C2, NR2F2 ABCC8 1939/4885KCNJ11 4762/4885KMT2A 968/4885
US-10472351-B2 Small molecule agonists and antagonists of NR2F6 activity in animals NR4A2, NR2C2, NR0B2 ABCC8 2042/4885KCNJ11 4724/4885KMT2A 904/4885

“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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