SCHEMBL1774656

SCHEMBL1774656

CN1CCN(c2nc(N)nc(N)c2Cc2cccc(F)c2)CC1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.64
HRH4 Q9H3N8 12/20 0.46
ADCY10 Q96PN6 2/20 0.45

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
SCHEMBL1774541 0.85 HTR6 (0.49) HTR6HRH4ADCY10
SCHEMBL18601620 0.85 HTR6 (0.49) HTR6HRH4ADCY10
SCHEMBL607201 0.82 HRH4 (0.59) HTR6HRH4ADCY10
SCHEMBL1774927 0.81 HTR6 (0.44) HTR6HRH4ADCY10
SCHEMBL1775372 0.81 HRH4 (0.52) HRH4
SCHEMBL1773989 0.81 HTR6 (0.44) HTR6HRH4ADCY10
SCHEMBL603299 0.72 HRH4 (0.51) HRH4
SCHEMBL12605070 0.70 HRH4 (0.78) HRH4
SCHEMBL1774881 0.69 HRH4 (0.49) HRH4
SCHEMBL1774183 0.69 HRH4 (0.55) HRH4

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
EP-1966162-B1 PYRIMIDINE DERIVATIVES ZIARCO PHARMA LTD (GB) 2017-03-15 EP disclosed
US-7943628-B2 Pyrimidine derivatives PFIZER LIMITED (GB) 2011-05-17 US 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 HTR6 2234/4885HRH4 184/4885ADCY10 2130/4885

“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.