SCHEMBL23309707

SCHEMBL23309707

O=C(Nc1ccc(OC(F)(F)F)cc1)c1cc(F)nc(F)c1F

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 8/20 0.54
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ HTT P42858 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ EPHX2 P34913 1/20 0.52
▸ TRPV1 Q8NER1 3/20 0.51
▸ NPC1 O15118 2/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ TSHR P16473 1/20 0.48
▸ MAPT P10636 1/20 0.47

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
SCHEMBL23309528 0.89 PRSS12 (0.44) ABL1MEN1KMT2AHTTSMN1; SMN2
SCHEMBL23309615 0.86 P2RX1 (0.58) HTTNPC1RAB9ATSHRMAPT
SCHEMBL23309730 0.86 KMT2A (0.47) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL23309617 0.84 NPC1 (0.54) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL23309645 0.82 ALDH1A1 (0.51) MEN1KMT2AHTTSMN1; SMN2TRPV1
SCHEMBL23309562 0.82 PNLIP (0.56) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL23309584 0.81 NPC1 (0.57) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL23309621 0.80 RAB9A (0.50) MEN1KMT2AHTTSMN1; SMN2NPC1
SCHEMBL23309708 0.80 RAB9A (0.52) KMT2AHTTSMN1; SMN2NPC1RAB9A
SCHEMBL23309490 0.79 GAA (0.51) MEN1KMT2AHTTSMN1; SMN2NPC1

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 ABL1 3397/4885MEN1 1633/4885KMT2A 2360/4885

“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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