SCHEMBL23309649

SCHEMBL23309649

O=C(Oc1ccc(Cl)cc1)c1cc(F)nc(F)c1F

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.46
▸ CYP1A2 P05177 2/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ ATM Q13315 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ CYP2D6 P10635 1/20 0.38
▸ CYP11B1 P15538 1/20 0.38
▸ CYP11B2 P19099 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL23309616 0.85 ALDH1A1 (0.49) CYP1A2CYP2C9CYP2C19ATMNPSR1
SCHEMBL23309607 0.85 MAPT (0.49) NPSR1MAPTTP53KMT2AMEN1
SCHEMBL23309722 0.82 POLB (0.45) CYP1A2MAPTTP53THRBKMT2A
SCHEMBL23309666 0.81 ALDH1A1 (0.52) MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL23309534 0.79 L3MBTL1 (0.51) CYP1A2CYP2C9CYP2C19NPSR1MAPT
SCHEMBL23309708 0.73 RAB9A (0.52) HTTKMT2ASMN1; SMN2
SCHEMBL23309619 0.73 NPC1 (0.40) CYP1A2CYP2C9CYP2C19ATMNPSR1
SCHEMBL9394319 0.70 HPGD (0.55) HTTCYP1A2CYP2C9CYP2C19ATM
SCHEMBL23309544 0.69 TSHR (0.48) HTTCYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL23309542 0.69 CA12 (0.42) CYP1A2CYP2C9CYP2C19MAPTTP53

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 HTT 2558/4885CYP1A2 1133/4885CYP2C9 1774/4885

“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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