SCHEMBL1774263

SCHEMBL1774263

CNC1CN(c2cc(NCc3ccccc3Cl)ncn2)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 6/20 0.47
HRH3 Q9Y5N1 1/20 0.47
PIK3CB P42338 1/20 0.44
MAPK1 P28482 3/20 0.43
CYP1A2 P05177 3/20 0.43
CYP3A4 P08684 3/20 0.43
TSHR P16473 3/20 0.43
CLK4 Q9HAZ1 3/20 0.43
TP53 P04637 2/20 0.43
CYP2D6 P10635 2/20 0.43
CYP2C19 P33261 2/20 0.43
HIF1A Q16665 1/20 0.43
GPR39 O43194 1/20 0.43
PRCP P42785 1/20 0.42
MAPK8 P45983 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MAP4K4 O95819 1/20 0.41
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL1774199 0.83 HRH4 (0.66) HRH4PIK3CBMAPK1CYP1A2CYP3A4
SCHEMBL1774241 0.78 HRH4 (0.52) HRH4HRH3
SCHEMBL1774066 0.77 HRH4 (0.53) HRH4HRH3PIK3CBPRCPRAB9A
SCHEMBL1774353 0.76 HRH4 (0.70) HRH4PIK3CBCLK4PRCPMAPK8
SCHEMBL1774043 0.75 HRH4 (0.50) HRH4HRH3
SCHEMBL1774181 0.74 HRH4 (0.55) HRH4HRH3
SCHEMBL1776496 0.74 HRH4 (0.65) HRH4HRH3PRCP
SCHEMBL1774192 0.74 HRH4 (0.54) HRH4HRH3PRCP
SCHEMBL1775582 0.74 HRH4 (0.55) HRH4HRH3GPR39PRCP
SCHEMBL1773904 0.74 HRH4 (0.50) HRH4HRH3MAPTDPP4

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 4 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
US-20070185075-A1 Pyrimidine derivatives PFIZER LIMITED 2007-08-09 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-20070185075-A1 Pyrimidine derivatives TYMS, DPYD, TYMP HRH4 184/4885HRH3 187/4885PIK3CB 1970/4885

“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.