SCHEMBL29629310

SCHEMBL29629310

CC(C)=NOC(=O)C1Oc2ccccc2Cc2ccccc2O1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.37
GABRA1 P14867 2/20 0.37
GABRB2 P47870 2/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
ACSL1 P33121 1/20 0.33
GAA P10253 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
LMNA P02545 1/20 0.32
HSD17B3 P37058 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 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
SCHEMBL9752005 0.80 MAOA (0.42) NISCHGABRA1GABRB2MAOAMAOB
SCHEMBL9751996 0.78 NISCH (0.53) NISCHGABRA1GABRB2MAOAMAOB
SCHEMBL10400768 0.77 MAOA (0.39) NISCHGABRA1GABRB2MAOAMAOB
SCHEMBL10400577 0.77 ALDH1A1 (0.47) SMN1; SMN2TDP1TSHRALDH1A1MEN1
SCHEMBL9753155 0.77 MAOA (0.39) NISCHGABRA1GABRB2MAOAMAOB
SCHEMBL10400578 0.75 ACSL1 (0.40) NISCHSMN1; SMN2GABRA1GABRB2MAOA
SCHEMBL9752907 0.74 ALDH1A1 (0.41) NISCHSMN1; SMN2MAOAMAOBTDP1
SCHEMBL9752721 0.73 MAOA (0.45) NISCHSMN1; SMN2GABRA1GABRB2MAOA
Potassium Ion SCHEMBL9752861 0.73 MAOA (0.45) NISCHSMN1; SMN2GABRA1GABRB2MAOA
SCHEMBL10400814 0.73 TSHR (0.43) NISCHGABRA1GABRB2MAOAMAOB

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
EP-3060043-B1 PESTICIDAL COMPOSITIONS AND RELATED METHODS CORTEVA AGRISCIENCE LLC (US) 2025-11-26 EP claimed
US-12098150-B2 Crystal of heterocyclic amide compound and method for producing same NISSAN CHEMICAL CORPORATION (JP) 2024-09-24 US disclosed
EP-3939977-B1 CRYSTAL OF HETEROCYCLIC AMIDE COMPOUND AND METHOD FOR PRODUCING SAME NISSAN CHEMICAL CORP (JP) 2024-05-08 EP disclosed
WO-2024038801-A1 AQUEOUS SUSPENSION-TYPE AGROCHEMICAL COMPOSITION 日産化学株式会社 2024-02-22 WO disclosed
US-20220153736-A1 CRYSTAL OF HETEROCYCLIC AMIDE COMPOUND AND METHOD FOR PRODUCING SAME NISSAN CHEMICAL CORPORATION (JP) 2022-05-19 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 (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-20220153736-A1 CRYSTAL OF HETEROCYCLIC AMIDE COMPOUND AND METHOD FOR PRODUCING SAME DDT, HDHD5, AADAC NISCH 166/4885SMN1; SMN2 4530/4885GABRA1 3436/4885
US-12098150-B2 Crystal of heterocyclic amide compound and method for producing same DDT, HDHD5, AADAC NISCH 166/4885SMN1; SMN2 4530/4885GABRA1 3436/4885

“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.