SCHEMBL4724671

SCHEMBL4724671

CCCCOc1cccc2[nH][c]c(-c3cccc4ccccc34)c12

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 8/20 0.44
HTR1D P28221 2/20 0.43
PDE5A O76074 3/20 0.42
PDE4A P27815 3/20 0.42
PDE4B Q07343 3/20 0.42
PDE4C Q08493 3/20 0.42
PDE4D Q08499 3/20 0.42
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CNR2 P34972 2/20 0.41
CNR1 P21554 1/20 0.41
SLC6A4 P31645 2/20 0.39
HRH1 P35367 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
SCHEMBL4720942 0.94 HTR1B (0.41) HTR1BHTR1DPDE5APDE4APDE4B
SCHEMBL4723591 0.89 ENPP1 (0.42) HTR1BPDE5A
SCHEMBL4723685 0.82 ABCG2 (0.43) GAATDP1CNR2
SCHEMBL4720474 0.81 CYP1A2 (0.42) HTR1BPDE5APDE4APDE4BPDE4C
SCHEMBL4722874 0.78 HTR1B (0.45) HTR1BHTR1DGAATDP1L3MBTL1
SCHEMBL4724583 0.75 PDE5A (0.37) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL4767284 0.74 HTR1B (0.46) HTR1BHTR1DGAATDP1L3MBTL1
SCHEMBL1004658 0.73 HTR1B (0.73) HTR1BHTR1DCNR2CNR1SLC6A4
SCHEMBL4721628 0.72 HTR1B (0.47) HTR1BHTR1DPDE5APDE4APDE4B
SCHEMBL5492669 0.71 BCHE (0.40) GAATDP1

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 HTR1B 111/4885HTR1D 94/4885PDE5A 269/4885

“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.