SCHEMBL4903232

SCHEMBL4903232

CC(C)(C)OC(=O)N1CCN(c2ncc(C(F)(F)F)cc2F)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
SLC6A9 P48067 4/20 0.52
KCNH2 Q12809 3/20 0.52
GPR119 Q8TDV5 3/20 0.49
SMN1; SMN2 Q16637 6/20 0.48
LMNA P02545 3/20 0.48
MAPT P10636 3/20 0.47
ALDH1A1 P00352 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HPGD P15428 2/20 0.46
KIT P10721 2/20 0.44
HTT P42858 1/20 0.44
CKS1B P61024 1/20 0.44
SKP1 P63208 1/20 0.44
SKP2 Q13309 1/20 0.44
CXCR3 P49682 1/20 0.43

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
SCHEMBL31027289 1.00 MEN1 (0.57) MEN1KMT2ASLC6A9KCNH2GPR119
SCHEMBL30851276 0.89 MEN1 (0.61) MEN1KMT2ASLC6A9GPR119SMN1; SMN2
SCHEMBL2365916 0.89 MEN1 (0.61) MEN1KMT2ASLC6A9GPR119SMN1; SMN2
SCHEMBL31410416 0.88 KMT2A (0.57) MEN1KMT2AGPR119SMN1; SMN2LMNA
SCHEMBL31410432 0.88 KMT2A (0.57) MEN1KMT2AGPR119SMN1; SMN2LMNA
SCHEMBL31410510 0.87 MEN1 (0.56) MEN1KMT2AGPR119SMN1; SMN2LMNA
SCHEMBL14598673 0.87 MEN1 (0.56) MEN1KMT2AGPR119SMN1; SMN2LMNA
SCHEMBL30940692 0.87 MEN1 (0.56) MEN1KMT2AKCNH2GPR119SMN1; SMN2
SCHEMBL31142882 0.87 KMT2A (0.76) MEN1KMT2ASMN1; SMN2LMNAMAPT
SCHEMBL2366233 0.87 KMT2A (0.76) MEN1KMT2ASMN1; SMN2LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023139536-A1 (4-PIPERAZIN-1YL)-4-ALKYL-PHTHALAZIN-1(2H)-ONE COMPOUNDS AS PARP7 INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-07-27 WO disclosed
CN-115745971-A PARP7 inhibitor and application thereof 重庆华森制药股份有限公司 2023-03-07 CN disclosed
US-20210246140-A1 MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-08-12 US disclosed
US-20210246140-A1 MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-08-12 US disclosed
WO-2021155196-A1 MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 THE GENERAL HOSPITAL CORPORATION (US) 2021-08-05 WO disclosed
US-20080287455-A1 SULFANYL SUBSTITUTED PHENYL METHANONES JOLIDON SYNESE 2008-11-20 US disclosed
US-20080287455-A1 SULFANYL SUBSTITUTED PHENYL METHANONES JOLIDON SYNESE 2008-11-20 US disclosed
US-20080287455-A1 SULFANYL SUBSTITUTED PHENYL METHANONES JOLIDON SYNESE 2008-11-20 US disclosed
EP-1836178-A1 SULFANYL SUBSTITUTED PHENYL METHANONES AS GLYCINE TRANSPORTER 1 (GLYT-1) INHIBITORS FOR THE TREATMENT OF NEUROLOGICAL AND NEUROPSYCHIATRIC DISORDERS F. Hoffmann-Roche AG (CH) 2007-09-26 EP disclosed
WO-2006072435-A1 SULFANYL SUBSTITUTED PHENYL METHANONES AS GLYCINE TRANSPORTER 1 (GLYT-1) INHIBITORS FOR THE TREATMENT OF NEUROLOGICAL AND NEUROPSYCHIATRIC DISORDERS F.HOFFMANN-LA ROCHE AG (CH) 2006-07-13 WO disclosed
US-20060149062-A1 Sulfanyl substituted phenyl methanones F. HOFFMANN-LA ROCHE AG (CH) 2006-07-06 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 (3 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-20060149062-A1 Sulfanyl substituted phenyl methanones SULT1A1, SULT2A1, SULT1E1 MEN1 1766/4885KMT2A 1819/4885SLC6A9 19/4885
US-20210246140-A1 MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 GRM1, GRM2, GRIN1 MEN1 2621/4885KMT2A 1106/4885SLC6A9 235/4885
US-20080287455-A1 SULFANYL SUBSTITUTED PHENYL METHANONES SULT1A1, SULT2A1, SULT1E1 MEN1 1766/4885KMT2A 1819/4885SLC6A9 19/4885

“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.