SCHEMBL6284124

SCHEMBL6284124

CC(C)(C)OC(=O)N1CCN(c2cncc(NCc3cccc(Cl)c3)n2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.54
CCNT1 O60563 1/20 0.49
CKS1B P61024 2/20 0.48
SKP1 P63208 2/20 0.48
SKP2 Q13309 2/20 0.48
HRH4 Q9H3N8 1/20 0.47
TP53 P04637 2/20 0.46
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAPT P10636 1/20 0.44
PGK1 P00558 1/20 0.43
MET P08581 1/20 0.42
ADORA2A P29274 1/20 0.42
SLC2A1 P11166 1/20 0.42
POLB P06746 1/20 0.42
STS P08842 1/20 0.42
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41

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
SCHEMBL6286362 0.83 HTR2A (0.63) ACHECKS1BSKP1SKP2TP53
SCHEMBL5883989 0.83 ACHE (0.79) ACHECCNT1
SCHEMBL5883101 0.83 ACHE (0.57) ACHECCNT1CKS1BSKP1SKP2
SCHEMBL22792004 0.80 ACHE (0.54) ACHECCNT1CKS1BSKP1SKP2
SCHEMBL6284131 0.80 CKS1B (0.44) ACHECKS1BSKP1SKP2TP53
SCHEMBL906005 0.77 HTR2C (0.63) ACHECCNT1HRH4TP53HTT
SCHEMBL6284838 0.77 CKS1B (0.52) ACHECKS1BSKP1SKP2HRH4
SCHEMBL30516377 0.77 ACHE (0.47) ACHECCNT1TP53MAPK1SMN1; SMN2
SCHEMBL21301932 0.77 ACHE (0.47) ACHECCNT1TP53MAPK1SMN1; SMN2
SCHEMBL22391614 0.76 ACHE (0.50) ACHECCNT1CKS1BSKP1SKP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6894050-B2 5-HT receptor ligands and uses thereof PFIZER INC. (US) 2005-05-17 US disclosed
US-20050090503-A1 5-HT receptor ligands and uses thereof PFIZER INC 2005-04-28 US disclosed
US-20050020604-A1 5-HT receptor ligands and uses thereof PFIZER INC 2005-01-27 US disclosed
EP-1401820-A1 5-HT RECEPTOR LIGANDS AND USES THEREOF Pfizer Products Inc. (US) 2004-03-31 EP disclosed
US-20030125334-A1 5-HT receptor ligands and uses thereof CHIANG PHOEBE (US) 2003-07-03 US disclosed
WO-2003000666-A1 5-HT RECEPTOR LIGANDS AND USES THEREOF PFIZER PRODUCTS INC. (US) 2003-01-03 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 (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-20050090503-A1 5-HT receptor ligands and uses thereof HTR2A, HTR1A, HTR5A ACHE 610/4885CCNT1 4270/4885CKS1B 4756/4885
US-20050020604-A1 5-HT receptor ligands and uses thereof HTR2A, HTR1A, HTR5A ACHE 610/4885CCNT1 4270/4885CKS1B 4756/4885
US-20030125334-A1 5-HT receptor ligands and uses thereof HTR1A, HTR2A, HTR5A ACHE 638/4885CCNT1 4088/4885CKS1B 4727/4885

“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.