SCHEMBL22337503

SCHEMBL22337503

CN1CC[C@@H](C(=O)Nc2cccc(F)c2F)C1=O

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.51
▸ KMT2A Q03164 4/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ TSHR P16473 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ CHRM3 P20309 3/20 0.40
▸ UBE2M P61081 1/20 0.40
▸ DCUN1D1 Q96GG9 1/20 0.40
▸ THRB P10828 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ HTR1F P30939 1/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ PKM P14618 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ RIPK1 Q13546 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37

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
SCHEMBL30486800 1.00 TP53 (0.51) TP53KMT2AMEN1TSHRSMN1; SMN2
SCHEMBL22337322 1.00 TP53 (0.51) TP53KMT2AMEN1TSHRSMN1; SMN2
SCHEMBL22591707 0.93 TP53 (0.49) TP53KMT2AMEN1TSHRSMN1; SMN2
SCHEMBL30486819 0.93 TP53 (0.49) TP53KMT2AMEN1TSHRSMN1; SMN2
SCHEMBL21662059 0.90 KMT2A (0.53) KMT2AMEN1TSHRSMN1; SMN2MAPT
SCHEMBL30486811 0.90 KMT2A (0.53) KMT2AMEN1TSHRSMN1; SMN2MAPT
SCHEMBL30486807 0.90 KMT2A (0.53) KMT2AMEN1TSHRSMN1; SMN2MAPT
SCHEMBL22310185 0.88 ALDH1A1 (0.49) TP53TSHRALDH1A1EPHX2
SCHEMBL22337571 0.86 TP53 (0.50) TP53KMT2AMEN1TSHRSMN1; SMN2
SCHEMBL27060609 0.86 TP53 (0.52) TP53KMT2AMEN1TSHRSMN1; SMN2

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-20240025853-A1 SUBSTITUTED CYCLIC AMIDES AND THEIR USE AS HERBICIDES FMC CORPORATION 2024-01-25 — — US disclosed
WO-2022033893-A1 HERBICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2022-02-17 — — WO disclosed
WO-2020161147-A1 HERBICIDAL MIXTURES SYNGENTA CROP PROTECTION AG (CH) 2020-08-13 — — WO disclosed
WO-2020161148-A2 PYRAZOLE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2020-08-13 — — WO 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-20240025853-A1 SUBSTITUTED CYCLIC AMIDES AND THEIR USE AS HERBICIDES NIT2, ARG1, CNPY2 TP53 1230/4885KMT2A 1693/4885MEN1 3362/4885

“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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