SCHEMBL22441575

SCHEMBL22441575

COc1cc2ncnc(N3CCC(OC(N)=O)CC3)c2cc1OC

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 11/20 0.65
ENPP1 P22413 6/20 0.64
MAPK1 P28482 1/20 0.64
ACHE P22303 2/20 0.63
BACE1 P56817 2/20 0.63
PDE3B Q13370 7/20 0.61
PDE3A Q14432 7/20 0.61

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
SCHEMBL22441523 0.83 ENPP1 (0.71) PDE10AENPP1MAPK1ACHEBACE1
SCHEMBL4969095 0.82 MAPK1 (0.74) PDE10AENPP1MAPK1ACHEBACE1
SCHEMBL10618244 0.82 MAPK1 (0.74) PDE10AENPP1MAPK1ACHEBACE1
SCHEMBL20782445 0.82 ENPP1 (0.74) PDE10AENPP1MAPK1ACHEBACE1
SCHEMBL7276406 0.82 ENPP1 (0.73) PDE10AENPP1MAPK1ACHEBACE1
SCHEMBL4965743 0.82 ENPP1 (0.70) PDE10AENPP1MAPK1ACHEBACE1
SCHEMBL22291145 0.81 ENPP1 (0.69) PDE10AENPP1MAPK1ACHEBACE1
SCHEMBL22441471 0.81 NCF1 (0.59) PDE10AMAPK1PDE3BPDE3A
Hydrochloric Acid SCHEMBL22441562 0.81 ENPP1 (0.72) PDE10AENPP1MAPK1ACHEBACE1
Hydrochloric Acid SCHEMBL29357602 0.81 ENPP1 (0.72) PDE10AENPP1MAPK1ACHEBACE1

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-11407729-B2 Quinoline and quinazoline compounds and methods of use thereof Stingray Therapeutics, Inc. (US) 2022-08-09 US disclosed
EP-3941459-A1 QUINOLINE AND QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF Stingray Therapeutics, Inc. (US) 2022-01-26 EP disclosed
CN-113924092-A Quinoline and quinazoline compounds and methods of use thereof 斯汀格瑞治疗股份有限公司 2022-01-11 CN disclosed
US-20200299258-A1 QUINOLINE AND QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF STINGRAY THERAPEUTICS INC (US) 2020-09-24 US disclosed
WO-2020190912-A1 QUINOLINE AND QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF Stingray Therapeutics, Inc. (US) 2020-09-24 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 (2 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-20200299258-A1 QUINOLINE AND QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF ENPP1, ENPP3, PDE7A PDE10A 482/4885ENPP1 1/4885MAPK1 1106/4885
US-11407729-B2 Quinoline and quinazoline compounds and methods of use thereof ENPP1, ENPP3, PDE7A PDE10A 482/4885ENPP1 1/4885MAPK1 1106/4885

“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.