SCHEMBL1774359

SCHEMBL1774359

CN1CCN(c2cc(NCC3CCCO3)ncn2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 7/20 0.56
HRH3 Q9Y5N1 2/20 0.56
HRH2 P25021 1/20 0.54
ALOX12 P18054 1/20 0.48
TNK2 Q07912 6/20 0.47
JAK2 O60674 2/20 0.47
SRC P12931 2/20 0.47
ALK Q9UM73 2/20 0.47
CHEK1 O14757 1/20 0.47
ABL1 P00519 1/20 0.47
LCK P06239 1/20 0.47
ROS1 P08922 1/20 0.47
FGFR1 P11362 1/20 0.47
TYK2 P29597 1/20 0.47
SYK P43405 1/20 0.44
ALDH1A1 P00352 3/20 0.43
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL1775219 1.00 HRH4 (0.56) HRH4HRH3HRH2ALOX12TNK2
SCHEMBL1774315 1.00 HRH4 (0.56) HRH4HRH3HRH2ALOX12TNK2
SCHEMBL1775555 0.81 HRH4 (0.65) HRH4HRH3HRH2ALDH1A1CYP1A2
SCHEMBL581687 0.77 HTT (0.50) HRH4TNK2ABL1LCKALDH1A1
SCHEMBL1588652 0.76 HRH4 (0.57) HRH4HRH3HRH2ALOX12TNK2
SCHEMBL1774487 0.76 HRH4 (0.72) HRH4HRH3HRH2ALDH1A1HPGD
SCHEMBL374080 0.75 HCAR3 (0.48) TNK2ABL1LCKALDH1A1HPGD
SCHEMBL4752569 0.74 HRH4 (0.70) HRH4HRH3HRH2ALDH1A1CYP1A2
SCHEMBL1774962 0.73 HRH4 (0.67) HRH4HRH3HRH2
SCHEMBL1775001 0.72 HRH4 (1.00) HRH4HRH3HRH2CYP1A2PIK3CB

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
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
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 187/4885HRH2 257/4885

“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.