SCHEMBL18797101

SCHEMBL18797101

Cc1cc2cccc(-c3c(O)c(C)nn(C)c3=O)c2o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 3/20 0.41
▸ ADORA1 P30542 2/20 0.36
▸ ADORA3 P0DMS8 1/20 0.36
▸ HTR1A P08908 2/20 0.34
▸ CDK8 P49336 1/20 0.34
▸ ACVR1 Q04771 1/20 0.34
▸ MAOB P27338 2/20 0.33
▸ IGF1R P08069 1/20 0.32
▸ NR3C2 P08235 1/20 0.32
▸ PDE6D O43924 1/20 0.32
▸ PDE5A O76074 1/20 0.32
▸ PDE6A P16499 1/20 0.32
▸ PDE6G P18545 1/20 0.32
▸ PDE6B P35913 1/20 0.32
▸ PDE6C P51160 1/20 0.32
▸ PDE6H Q13956 1/20 0.32
▸ CREBBP Q92793 1/20 0.32
▸ CRBN Q96SW2 1/20 0.32
▸ CASR P41180 1/20 0.32
▸ MEN1 O00255 2/20 0.32

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
SCHEMBL18797090 0.85 HTR1A (0.36) MAOAADORA1ADORA3HTR1ACDK8
SCHEMBL18797093 0.84 ADORA2A (0.38) MAOAADORA1ADORA3HTR1AMAOB
SCHEMBL18797105 0.81 GAA (0.35) MAOAHTR1ACDK8ACVR1PDE6D
SCHEMBL17224789 0.78 DHFR (0.43) CDK8ACVR1MEN1MAPTKMT2A
SCHEMBL30576349 0.78 DHFR (0.43) CDK8ACVR1MEN1MAPTKMT2A
SCHEMBL11965000 0.74 CDK8 (0.44) CDK8ACVR1PDE6DPDE5APDE6A
SCHEMBL15935620 0.70 ESR2 (0.42) CDK8ACVR1MEN1MAPTKMT2A
SCHEMBL18797103 0.69 KDM4E (0.36) HTR1ACDK8ACVR1PDE6DPDE5A
SCHEMBL17224744 0.69 MCL1 (0.36) ADORA1ADORA3CDK8ACVR1MAPT
SCHEMBL30576372 0.69 MCL1 (0.36) ADORA1ADORA3CDK8ACVR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3368523-B1 NOVEL PYRIDAZINONE HERBICIDES FMC CORP (US) 2021-07-14 — — EP disclosed
CN-108495849-B Pyridazinone herbicides FMC公司 2020-11-10 — — CN disclosed
US-10750743-B2 Pyridazinone herbicides FMC CORPORATION (US) 2020-08-25 — — US disclosed
US-20180332851-A1 NOVEL PYRIDAZINONE HERBICIDES FMC CORPORATION 2018-11-22 — — US disclosed
EP-3368523-A1 NOVEL PYRDAZINONE HERBICIDES E. I. du Pont de Nemours and Company (US) 2018-09-05 — — EP disclosed
CN-108495849-A Novel pyridazine herbicides FMC公司 2018-09-04 — — CN disclosed
WO-2017074992-A1 NOVEL PYRDAZINONE HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2017-05-04 — — 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-10750743-B2 Pyridazinone herbicides PRDX4, PRDX6, PDXK MAOA 899/4885ADORA1 884/4885ADORA3 382/4885
US-20180332851-A1 NOVEL PYRIDAZINONE HERBICIDES PRDX4, PRDX6, PDXK MAOA 1157/4885ADORA1 1072/4885ADORA3 392/4885

“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.

Send feedback