SCHEMBL20044128

SCHEMBL20044128

COc1ccc([C@H]2CN(C)C(=O)[C@@H]2C(=O)Nc2ccccc2F)cc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 1/20 0.42
ALDH1A1 P00352 5/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
LMNA P02545 3/20 0.42
KDM4E B2RXH2 2/20 0.42
PDE4D Q08499 1/20 0.42
TP53 P04637 1/20 0.42
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
KDM1A O60341 2/20 0.41
FPR1 P21462 1/20 0.41
FPR2 P25090 1/20 0.41
F10 P00742 1/20 0.41
USP2 O75604 1/20 0.40
GAA P10253 2/20 0.39

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
SCHEMBL20043951 0.94 ALDH1A1 (0.46) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL20044127 0.92 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3KMT2AMEN1
SCHEMBL20044360 0.92 KMT2A (0.42) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL20044129 0.91 ALDH1A1 (0.43) SLC6A2SLC6A4SLC6A3KMT2AMEN1
SCHEMBL20044094 0.90 ALDH1A1 (0.41) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL20044403 0.89 KMT2A (0.40) SLC6A2SLC6A4SLC6A3KMT2AMEN1
SCHEMBL20044462 0.89 SMN1; SMN2 (0.44) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL18281122 0.89 MEN1 (0.46) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL21013027 0.89 MEN1 (0.46) KMT2AMEN1MAPTALDH1A1SMN1; SMN2
SCHEMBL22621465 0.89 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3MAPTKDM1A

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 10 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
US-20240025853-A1 SUBSTITUTED CYCLIC AMIDES AND THEIR USE AS HERBICIDES FMC CORPORATION 2024-01-25 US disclosed
US-11787765-B2 Substituted cyclic amides and their use as herbicides FMC CORPORATION (US) 2023-10-17 US disclosed
US-11787765-B2 Substituted cyclic amides and their use as herbicides FMC CORPORATION (US) 2023-10-17 US disclosed
US-20220127229-A1 SUBSTITUTED CYCLIC AMIDES AND THEIR USE AS HERBICIDES FMC CORPORATION 2022-04-28 US disclosed
US-11180453-B2 Substituted cyclic amides and their use as herbicides FMC CORPORATION (US) 2021-11-23 US disclosed
US-20200347017-A1 SUBSTITUTED CYCLIC AMIDES AND THEIR USE AS HERBICIDES FMC CORPORATION 2020-11-05 US disclosed
US-10654804-B2 Substituted cyclic amides and their use as herbicides FMC CORPORATION (US) 2020-05-19 US disclosed
US-20180099935-A1 SUBSTITUTED CYCLIC AMIDES AND THEIR USE AS HERBICIDES FMC CORPORATION 2018-04-12 US disclosed
US-20180099935-A1 SUBSTITUTED CYCLIC AMIDES AND THEIR USE AS HERBICIDES FMC CORPORATION 2018-04-12 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 (7 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-11787765-B2 Substituted cyclic amides and their use as herbicides NIT2, ARG1, CNPY2 SLC6A2 1357/4885SLC6A4 2348/4885SLC6A3 1618/4885
US-20180099935-A1 SUBSTITUTED CYCLIC AMIDES AND THEIR USE AS HERBICIDES NIT2, ARG1, CNPY2 SLC6A2 1357/4885SLC6A4 2348/4885SLC6A3 1618/4885
US-10654804-B2 Substituted cyclic amides and their use as herbicides NIT2, ARG1, CNPY2 SLC6A2 1357/4885SLC6A4 2348/4885SLC6A3 1618/4885
US-20240025853-A1 SUBSTITUTED CYCLIC AMIDES AND THEIR USE AS HERBICIDES NIT2, ARG1, CNPY2 SLC6A2 1363/4885SLC6A4 2341/4885SLC6A3 1625/4885
US-20220127229-A1 SUBSTITUTED CYCLIC AMIDES AND THEIR USE AS HERBICIDES NIT2, ARG1, CNPY2 SLC6A2 1357/4885SLC6A4 2348/4885SLC6A3 1618/4885
US-20200347017-A1 SUBSTITUTED CYCLIC AMIDES AND THEIR USE AS HERBICIDES NIT2, ARG1, CNPY2 SLC6A2 1357/4885SLC6A4 2348/4885SLC6A3 1618/4885
US-11180453-B2 Substituted cyclic amides and their use as herbicides NIT2, ARG1, CNPY2 SLC6A2 1357/4885SLC6A4 2348/4885SLC6A3 1618/4885

“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.