SCHEMBL20767017

SCHEMBL20767017

COc1cc(F)c(F)cc1CNC1CCN(C)CC1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.54
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
HTT P42858 2/20 0.54
GAA P10253 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALDH1A1 P00352 3/20 0.49
POLB P06746 2/20 0.44
HTR2A P28223 2/20 0.41
KDM1A O60341 2/20 0.41
BCHE P06276 2/20 0.41
ACHE P22303 2/20 0.41
BACE1 P56817 2/20 0.41
MAPT P10636 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
QDPR P09417 1/20 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
SCHEMBL4630869 0.88 MEN1 (0.62) KDM4EMEN1KMT2AHTTGAA
SCHEMBL4733093 0.80 TSHR (0.57) KDM4EMEN1KMT2AHTTGAA
SCHEMBL20767035 0.79 DPP4 (0.53) KDM4EMEN1KMT2AHTTGAA
SCHEMBL22361712 0.78 KDM1A (0.53) KDM4EMEN1KMT2AHTTGAA
SCHEMBL30523637 0.78 KDM1A (0.53) KDM4EMEN1KMT2AHTTGAA
SCHEMBL30933761 0.76 NPBWR1 (0.48) KDM4EMEN1KMT2AHTTGAA
SCHEMBL30933758 0.76 NPBWR1 (0.48) KDM4EMEN1KMT2AHTTGAA
SCHEMBL20766753 0.74 BCHE (0.64) KDM4EMEN1KMT2AHTTTDP1
SCHEMBL29546328 0.74 BCHE (0.64) KDM4EMEN1KMT2AHTTTDP1
SCHEMBL30873498 0.74 ALDH1A1 (0.47) KDM4EMEN1KMT2AHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11440884-B2 Compounds, salts thereof and methods for treatment of diseases ACADIA PHARMACEUTICALS INC. (US) 2022-09-13 US disclosed
US-20210122713-A1 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA PHARMACEUTICALS INC. (US) 2021-04-29 US disclosed
US-20210122713-A1 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA PHARMACEUTICALS INC. (US) 2021-04-29 US disclosed
EP-3672960-A2 COMPOUNDS, SALTS THEREOF AND THEIR USE FOR THE TREATMENT OF DISEASES Acadia Pharmaceuticals Inc. (US) 2020-07-01 EP disclosed
WO-2019040104-A2 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA PHARMACEUTICALS INC. (US) 2019-02-28 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 (2 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-11440884-B2 Compounds, salts thereof and methods for treatment of diseases SLC10A1, VHL, CYP11B2 KDM4E 3819/4885MEN1 264/4885KMT2A 3216/4885
US-20210122713-A1 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES SLC10A1, VHL, CYP11B2 KDM4E 3819/4885MEN1 264/4885KMT2A 3216/4885

“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.