SCHEMBL14375346

SCHEMBL14375346

CC1CCN(Cc2c[nH]c3ccc(F)cc23)CC1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MPO P05164 6/20 0.72
DRD2 P14416 2/20 0.67
DRD4 P21917 2/20 0.67
DRD3 P35462 2/20 0.67
HTR1A P08908 4/20 0.55
OPRM1 P35372 1/20 0.55
OPRK1 P41145 1/20 0.55
OPRL1 P41146 1/20 0.55
GPR84 Q9NQS5 1/20 0.54
SLC6A4 P31645 2/20 0.53
SOS1 Q07889 1/20 0.53
MAPK1 P28482 1/20 0.52
PDE2A O00408 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL13375737 0.87 MPO (0.69) MPODRD2DRD4DRD3HTR1A
SCHEMBL13374358 0.86 MPO (0.67) MPODRD2DRD4DRD3HTR1A
SCHEMBL5170221 0.85 MPO (0.77) MPODRD2DRD4DRD3HTR1A
SCHEMBL13499605 0.84 MPO (1.00) MPODRD2DRD4DRD3HTR1A
SCHEMBL9635445 0.82 MPO (0.73) MPODRD2DRD4DRD3HTR1A
SCHEMBL13504100 0.81 DRD2 (1.00) DRD2DRD4DRD3MAPK1L3MBTL1
SCHEMBL23179558 0.76 ACHE (0.51) DRD2DRD4DRD3PDE2A
SCHEMBL6695064 0.75 DRD2 (0.67) MPODRD2DRD4DRD3HTR1A
SCHEMBL5198405 0.75 DRD2 (0.71) MPODRD2DRD4DRD3HTR1A
SCHEMBL13499597 0.75 SLC6A4 (0.69) MPOHTR1ASLC6A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine ASTRAZENECA AB (SE) 2007-10-18 US disclosed
US-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine ASTRAZENECA AB (SE) 2007-10-18 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 (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-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine CXCR4, CXCR1, CXCR3 MPO 414/4885DRD2 2462/4885DRD4 1261/4885

“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.