SCHEMBL21033058

SCHEMBL21033058

COc1ccc(-c2noc(Cn3ncc(C)cc3=O)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.56
▸ MAPT P10636 8/20 0.53
▸ HTT P42858 3/20 0.53
▸ TDP1 Q9NUW8 2/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ TP53 P04637 1/20 0.53
▸ LMNA P02545 6/20 0.49
▸ TSHR P16473 5/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ ATM Q13315 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ RECQL P46063 1/20 0.48
▸ NPY1R P25929 1/20 0.48
▸ NPY2R P49146 1/20 0.48
▸ SIRT2 Q8IXJ6 1/20 0.48

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
SCHEMBL20435883 0.88 HPGD (0.55) HPGDMAPTHTTTDP1ALDH1A1
SCHEMBL20435866 0.82 HPGD (0.56) HPGDMAPTHTTTDP1ALDH1A1
SCHEMBL20435747 0.82 HPGD (0.61) HPGDMAPTHTTTDP1ALDH1A1
SCHEMBL20435723 0.81 AKR1B1 (0.54) HPGDMAPTHTTTDP1ALDH1A1
SCHEMBL20435725 0.80 HPGD (0.58) HPGDMAPTHTTTDP1ALDH1A1
SCHEMBL20435858 0.79 HPGD (0.55) HPGDMAPTHTTALDH1A1TP53
SCHEMBL20435874 0.78 HPGD (0.60) HPGDMAPTHTTTDP1LMNA
SCHEMBL23528329 0.77 HPGD (0.58) HPGDMAPTHTTTDP1ALDH1A1
SCHEMBL20435870 0.77 HPGD (0.58) HPGDMAPTHTTTDP1ALDH1A1
SCHEMBL20435873 0.77 CYP1A2 (0.55) HPGDMAPTHTTTDP1TP53

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 5 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-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-2019104199-A1 SMALL MOLECULE AGONISTS AND ANTAGONISTS OF NR2F6 ACTIVITY REGEN BIOPHARMA INC. (US) 2019-05-31 — — WO disclosed
WO-2019104201-A1 SMALL MOLECULE AGONISTS AND ANTAGONISTS OF NR2F6 ACTIVITY IN NON-HUMANS Zander Therapeutics, Inc. (US) 2019-05-31 — — 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 (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-20200071307-A1 SMALL MOLECULE AGONISTS AND ANTAGONISTS OF NR2F6 ACTIVITY IN ANIMALS NR4A2, NR2C2, NR0B2 HPGD 3537/4885MAPT 4139/4885HTT 3928/4885
US-11377442-B2 Small molecule agonists and antagonists of NR2F6 activity NR4A2, NR2C2, NR2F2 HPGD 3275/4885MAPT 4240/4885HTT 4280/4885
US-10472351-B2 Small molecule agonists and antagonists of NR2F6 activity in animals NR4A2, NR2C2, NR0B2 HPGD 3537/4885MAPT 4139/4885HTT 3928/4885

“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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