SCHEMBL23309594

SCHEMBL23309594

Cc1cccc(C)c1NC(=O)c1cc(F)nc(F)c1F

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.50
▸ PTGER4 P35408 1/20 0.48
▸ MAOA P21397 2/20 0.47
▸ MAOB P27338 2/20 0.47
▸ MAPK1 P28482 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ KMT2A Q03164 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ RORC P51449 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ CYP3A4 P08684 1/20 0.42
▸ S1PR4 O95977 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ CHRNA7 P36544 1/20 0.41

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
SCHEMBL23309614 0.87 LCK (0.45) ALDH1A1
SCHEMBL23309697 0.84 HTT (0.56) POLBMAOBMAPK1ALDH1A1NPC1
SCHEMBL23309536 0.81 MEN1 (0.55) MAOAMAOBALDH1A1NPC1KDM4E
SCHEMBL23309483 0.79 CYP1A2 (0.52) POLBMAOAMAOBALDH1A1NPC1
SCHEMBL23309730 0.79 KMT2A (0.47) MAOAMAOBMAPK1ALDH1A1NPC1
SCHEMBL23309621 0.78 RAB9A (0.50) POLBMAOAMAOBALDH1A1NPC1
SCHEMBL23309702 0.78 ALDH1A1 (0.55) POLBALDH1A1NPC1KDM4EKMT2A
SCHEMBL23309490 0.78 GAA (0.51) POLBMAOAMAOBALDH1A1NPC1
SCHEMBL23309587 0.77 MAPT (0.47) POLBMAOAMAOBALDH1A1KDM4E
SCHEMBL23309725 0.75 GAA (0.43) MAOAMAOBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210120817-A1 PLANT DISEASE CONTROL AGENT MEIJI SEIKA PHARMA CO., LTD. (JP) 2021-04-29 — — 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 (1 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-20210120817-A1 PLANT DISEASE CONTROL AGENT BROX, ALG1, CTRL POLB 1411/4885PTGER4 3642/4885MAOA 1498/4885

“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.

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