SCHEMBL4720537

SCHEMBL4720537

CCOC1(c2ccccc2)COCC[N]1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
OPRL1 P41146 1/20 0.35
ADRA1D P25100 4/20 0.34
NPSR1 Q6W5P4 1/20 0.33
CHRM2 P08172 6/20 0.33
CHRM4 P08173 6/20 0.33
CHRM5 P08912 6/20 0.33
CHRM1 P11229 6/20 0.33
CHRM3 P20309 6/20 0.33
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
CYP2C19 P33261 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.31
ADRA1A P35348 3/20 0.31

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
SCHEMBL4724737 0.88 HTR1A (0.38) HTR1AOPRM1OPRD1OPRK1OPRL1
SCHEMBL4723802 0.85 CYP2C9 (0.41) HTR1ASMN1; SMN2ADRA1DNPSR1CYP2C19
SCHEMBL561639 0.85 BACE1 (0.33) OPRM1
SCHEMBL4722162 0.84 ALOX5 (0.34) HTR1ASMN1; SMN2ADRA1DCHRM2CHRM4
SCHEMBL4720742 0.79 SLC6A3 (0.36) HTR1ASMN1; SMN2NPSR1GAA
SCHEMBL4724846 0.78 OPRM1 (0.39) SMN1; SMN2OPRM1OPRD1OPRK1OPRL1
SCHEMBL4720350 0.76 OPRM1 (0.38) SMN1; SMN2OPRM1OPRD1OPRK1OPRL1
SCHEMBL4722907 0.74 OPRM1 (0.38) SMN1; SMN2OPRM1OPRD1OPRK1OPRL1
SCHEMBL4765489 0.74 OPRM1 (0.34) SMN1; SMN2OPRM1OPRD1OPRK1OPRL1
SCHEMBL4723344 0.69 SLC6A3 (0.35) HTR1ANPSR1

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 HTR1A 93/4885SMN1; SMN2 4511/4885OPRM1 1608/4885

“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.