SCHEMBL20435872

SCHEMBL20435872

COc1cccc(-c2noc(Cn3ncc4ccccc4c3=O)n2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.55
▸ CYP1A2 P05177 2/20 0.55
▸ CYP3A4 P08684 2/20 0.55
▸ CYP2C9 P11712 2/20 0.55
▸ CYP2C19 P33261 2/20 0.55
▸ GFER P55789 1/20 0.55
▸ GRIN1 Q05586 1/20 0.49
▸ GRIN2B Q13224 1/20 0.49
▸ MAPT P10636 5/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ NPBWR1 P48145 1/20 0.49
▸ ADORA3 P0DMS8 1/20 0.49
▸ ADORA2B P29275 1/20 0.49
▸ ADORA1 P30542 1/20 0.49
▸ MAOA P21397 1/20 0.47
▸ MAOB P27338 1/20 0.47
▸ AURKA O14965 1/20 0.47
▸ GRK2 P25098 1/20 0.47
▸ ROCK1 Q13464 1/20 0.47
▸ RPS6KA1 Q15418 1/20 0.47

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
SCHEMBL20435874 0.89 HPGD (0.60) HPGDMAPTSMN1; SMN2NPBWR1NPC1
SCHEMBL20435871 0.85 CYP1A2 (0.58) HPGDCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL20435859 0.84 CYP1A2 (0.55) HPGDCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL20435868 0.82 CYP1A2 (0.57) HPGDCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL20435873 0.81 CYP1A2 (0.55) HPGDCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL20435885 0.81 AKR1B1 (0.64) HPGDMAPTSMN1; SMN2ADORA3ADORA2B
SCHEMBL20435891 0.79 CYP1A2 (0.58) HPGDCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL17558239 0.76 DGAT2 (0.60) NPBWR1
SCHEMBL1544017 0.74 MAPT (0.65) CYP1A2CYP3A4CYP2C9CYP2C19MAPT
SCHEMBL28869603 0.74 MAPT (0.61) HPGDCYP1A2CYP3A4CYP2C9CYP2C19

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 HPGD 3307/4885CYP1A2 1825/4885CYP3A4 3020/4885
US-20200071307-A1 SMALL MOLECULE AGONISTS AND ANTAGONISTS OF NR2F6 ACTIVITY IN ANIMALS NR4A2, NR2C2, NR0B2 HPGD 3537/4885CYP1A2 2074/4885CYP3A4 3544/4885
US-20190054118-A1 Small Molecule Agonists and Antagonists of NR2F6 Activity in Animals NR4A2, NR2C2, NR0B2 HPGD 3537/4885CYP1A2 2074/4885CYP3A4 3544/4885
US-11324719-B2 Small molecule agonists and antagonists of NR2F6 activity in humans NR4A2, NR2C2, NR0B2 HPGD 3307/4885CYP1A2 1825/4885CYP3A4 3020/4885
US-11377442-B2 Small molecule agonists and antagonists of NR2F6 activity NR4A2, NR2C2, NR2F2 HPGD 3275/4885CYP1A2 2300/4885CYP3A4 3450/4885
US-10472351-B2 Small molecule agonists and antagonists of NR2F6 activity in animals NR4A2, NR2C2, NR0B2 HPGD 3537/4885CYP1A2 2074/4885CYP3A4 3544/4885

“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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