SCHEMBL25923623

SCHEMBL25923623

CC(C)=NOCc1cccc(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.55
IDO1 P14902 2/20 0.55
AGXT P21549 2/20 0.55
ENPP2 Q13822 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
MAOB P27338 6/20 0.51
MAOA P21397 3/20 0.51
CYP2C9 P11712 1/20 0.50
TSHR P16473 1/20 0.50
CYP2C19 P33261 1/20 0.50
PPARG P37231 1/20 0.49
PPARA Q07869 1/20 0.49
MAPT P10636 1/20 0.49
PNMT P11086 2/20 0.46
RXRA P19793 1/20 0.45
RXRB P28702 1/20 0.45
RXRG P48443 1/20 0.45
HCAR2 Q8TDS4 1/20 0.45

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
SCHEMBL2755831 0.82 IDO1 (0.55) CYP3A4IDO1NPC1RAB9AMAOB
SCHEMBL25923622 0.81 IDO1 (0.53) CYP3A4IDO1AGXTRAB9AMAOB
SCHEMBL25923625 0.79 L3MBTL1 (0.50) CYP3A4IDO1AGXTNPC1RAB9A
SCHEMBL3265545 0.79 IDO1 (0.57) CYP3A4IDO1AGXTMAOBCYP2C9
SCHEMBL678711 0.79 MAPT (0.57) CYP3A4IDO1NPC1RAB9AMAOB
SCHEMBL20267796 0.78 CYP3A4 (0.58) CYP3A4IDO1AGXTENPP2MAOB
SCHEMBL14099985 0.78 NPC1 (0.52) CYP3A4IDO1AGXTENPP2NPC1
SCHEMBL17986312 0.77 CYP3A4 (0.62) CYP3A4IDO1AGXTENPP2MAOB
SCHEMBL10744306 0.77 RXRA (0.51) CYP3A4IDO1AGXTNPC1RAB9A
SCHEMBL15631232 0.77 RAB9A (0.69) NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230337672-A1 METHOD OF CONTROLLING SOYBEAN RUST FUNGUS HAVING RESISTANCE TO QoI FUNGICIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-26 US disclosed
US-20230337672-A1 METHOD OF CONTROLLING SOYBEAN RUST FUNGUS HAVING RESISTANCE TO QoI FUNGICIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-26 US disclosed
US-20230232827-A1 METHOD FOR CONTROLLING SOYBEAN RUST FUNGUS RESISTANT TO QoI FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-07-27 US disclosed
US-20230232827-A1 METHOD FOR CONTROLLING SOYBEAN RUST FUNGUS RESISTANT TO QoI FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-07-27 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-20230337672-A1 METHOD OF CONTROLLING SOYBEAN RUST FUNGUS HAVING RESISTANCE TO QoI FUNGICIDE CYC1, SQOR, MT-CO1 CYP3A4 331/4885IDO1 1021/4885AGXT 712/4885
US-20230232827-A1 METHOD FOR CONTROLLING SOYBEAN RUST FUNGUS RESISTANT TO QoI FUNGICIDES CYC1, SQOR, MT-CO3 CYP3A4 350/4885IDO1 1034/4885AGXT 378/4885

“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.