SCHEMBL21799397

SCHEMBL21799397

CCOC(=O)c1nn(-c2cccnc2)cc1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.54
RAB9A P51151 4/20 0.54
LRRK2 Q5S007 4/20 0.47
NPSR1 Q6W5P4 2/20 0.46
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
POLB P06746 1/20 0.45
GLA P06280 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
SGMS2 Q8NHU3 1/20 0.44
GABRA1 P14867 1/20 0.44
GABRA5 P31644 1/20 0.44
PPIA P62937 2/20 0.44
LMNA P02545 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL21799396 0.87 SGMS2 (0.49) LRRK2NPSR1ALDH1A1KMT2AMEN1
SCHEMBL21799424 0.85 SGMS2 (0.47) LRRK2NPSR1ALDH1A1KMT2ASGMS2
SCHEMBL24505868 0.85 NPC1 (0.54) NPC1RAB9ANPSR1MAPK1ALDH1A1
SCHEMBL21799389 0.82 NPC1 (0.48) NPC1RAB9ANPSR1MAPK1ALDH1A1
SCHEMBL21799412 0.82 NPC1 (0.47) NPC1RAB9ANPSR1MAPK1ALDH1A1
SCHEMBL19019669 0.80 NPC1 (0.50) NPC1RAB9ANPSR1MAPK1ALDH1A1
SCHEMBL19019666 0.80 NPC1 (0.74) NPC1RAB9ANPSR1MAPK1ALDH1A1
SCHEMBL22983017 0.80 NPC1 (0.47) NPC1RAB9ANPSR1MAPK1ALDH1A1
SCHEMBL29413953 0.80 NPC1 (0.47) NPC1RAB9ANPSR1MAPK1ALDH1A1
SCHEMBL30662294 0.80 NPC1 (0.47) NPC1RAB9ANPSR1MAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11993578-B2 Pyrazole-3-carboxylic acid amide derivative and pest control agent KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2024-05-28 US disclosed
CN-110612295-B Pyrazole-3-carboxylic acid amide derivative and pest control agent 组合化学工业株式会社 2023-07-14 CN disclosed
EP-3623365-B1 PYRAZOLE-3-CARBOXYLIC ACID AMIDE DERIVATIVE AND PEST CONTROL AGENT KUMIAI CHEMICAL INDUSTRY CO (JP) 2023-01-04 EP disclosed
US-20200199096-A1 PYRAZOLE-3-CARBOXYLIC ACID AMIDE DERIVATIVE AND PEST CONTROL AGENT KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2020-06-25 US disclosed
EP-3623365-A1 PYRAZOLE-3-CARBOXYLIC ACID AMIDE DERIVATIVE AND PEST CONTROL AGENT Kumiai Chemical Industry Co., Ltd. (JP) 2020-03-18 EP disclosed
CN-110612295-A Pyrazole-3-carboxylic acid amide derivative and pest control agent 组合化学工业株式会社 2019-12-24 CN 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-20200199096-A1 PYRAZOLE-3-CARBOXYLIC ACID AMIDE DERIVATIVE AND PEST CONTROL AGENT H1-3, HDAC3, H1-0 NPC1 3658/4885RAB9A 166/4885LRRK2 1102/4885
US-11993578-B2 Pyrazole-3-carboxylic acid amide derivative and pest control agent H1-3, HDAC3, H1-0 NPC1 3658/4885RAB9A 166/4885LRRK2 1102/4885

“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.