SCHEMBL4723754

SCHEMBL4723754

CCCCN(C)c1ccn[c]n1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.38
MAPT P10636 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
AR P10275 1/20 0.35
LATS1 O95835 1/20 0.34
LATS2 Q9NRM7 1/20 0.34
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
HCAR3 P49019 1/20 0.31
PTPN11 Q06124 1/20 0.31
CNR1 P21554 1/20 0.30
SLC6A2 P23975 1/20 0.30

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
SCHEMBL4722993 0.89 HCAR3 (0.39) HRH3HCAR3SLC6A2
SCHEMBL933786 0.86 HRH3 (0.41) HRH3KDM4EALDH1A1
SCHEMBL4724804 0.84 LMNA (0.35) MAPTKDM4EALDH1A1TDP1
SCHEMBL2068294 0.83 HRH3 (0.33) HRH3
SCHEMBL995154 0.81 HRH3 (0.51) HRH3KDM4ESLC6A2
SCHEMBL4763808 0.81 HCAR3 (0.34) MAPTKDM4EALDH1A1TDP1HCAR3
SCHEMBL4724811 0.81 MAPT (0.35) MAPTKDM4EALDH1A1TDP1
SCHEMBL4722558 0.76 HCAR3 (0.38) ARHCAR3
SCHEMBL15415022 0.75 HCAR3 (0.35) HRH3ALDH1A1HCAR3
SCHEMBL1853793 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080176857-A1 4-Piperazinnylthieno[2,3-d]Pyrimidine Compounds as Platelet Aggregation Inhibitors PFIZER INC. 2008-07-24 US disclosed
EP-1874780-A1 4-PIPERAZINYLTHIENO[2,3-D]PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS Pharmacia & Upjohn Company LLC (US) 2008-01-09 EP disclosed
WO-2006100591-A1 4-PIPERAZINNYLTHIENO [2,3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-09-28 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-20080176857-A1 4-Piperazinnylthieno[2,3-d]Pyrimidine Compounds as Platelet Aggregation Inhibitors TBXA2R, P2RY4, PF4 HRH3 80/4885MAPT 4361/4885KDM4E 2584/4885

“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.