SCHEMBL1774333

SCHEMBL1774333

CNC1CN(c2cc(N3CCOCC3)nc(N)n2)C1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.63
HRH4 Q9H3N8 14/20 0.63
CRHBP P24387 1/20 0.60
CRHR2 Q13324 1/20 0.60
CYP1A2 P05177 1/20 0.56
CYP2D6 P10635 1/20 0.56
MAPT P10636 1/20 0.56

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
SCHEMBL1774835 0.91 HRH4 (0.78) HRH3HRH4
SCHEMBL1773938 0.85 HRH4 (0.79) HRH3HRH4CRHBPCRHR2
SCHEMBL1774685 0.84 HRH3 (0.55) HRH3HRH4
SCHEMBL1775307 0.84 HRH3 (0.55) HRH3HRH4
SCHEMBL604610 0.83 HRH4 (0.71) HRH3HRH4
SCHEMBL3293436 0.83 CRHBP (0.77) HRH3HRH4CRHBPCRHR2CYP1A2
SCHEMBL604406 0.81 HRH4 (0.69) HRH3HRH4
SCHEMBL18019805 0.78 NUDT1 (0.74) HRH4CRHBPCRHR2CYP1A2CYP2D6
SCHEMBL2166591 0.77 HRH4 (0.73) HRH3HRH4CRHBPCRHR2CYP1A2
SCHEMBL1774636 0.77 HRH3 (0.64) HRH3HRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966162-B1 PYRIMIDINE DERIVATIVES ZIARCO PHARMA LTD (GB) 2017-03-15 EP disclosed
CN-101341134-B Pyrimidine derivatives PFIZER LTD 2013-05-01 CN disclosed
US-7943628-B2 Pyrimidine derivatives PFIZER LIMITED (GB) 2011-05-17 US disclosed
CN-101341134-A Pyrimidine derivatives PFIZER LTD (GB) 2009-01-07 CN disclosed
EP-1966162-A2 PYRIMIDINE DERIVATIVES Pfizer Limited (GB) 2008-09-10 EP disclosed
US-20070185075-A1 Pyrimidine derivatives PFIZER LIMITED 2007-08-09 US disclosed
WO-2007072163-A2 PYRIMIDINE DERIVATIVES PFIZER LIMITED (GB) 2007-06-28 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 (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-20070185075-A1 Pyrimidine derivatives TYMS, DPYD, TYMP HRH3 187/4885HRH4 184/4885CRHBP 4518/4885

“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.