SCHEMBL4720205

SCHEMBL4720205

CCCOC1(c2ccccc2)CNCC[N]1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
OPRL1 P41146 1/20 0.36
HTR2A P28223 1/20 0.36
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL4723024 0.92 USP2 (0.40) OPRM1OPRL1HTR2AUSP2ALDH1A1
SCHEMBL4722907 0.88 OPRM1 (0.38) OPRM1OPRD1OPRK1OPRL1HTR2A
SCHEMBL1255254 0.80 HTR2A (0.41) OPRM1HTR2AALDH1A1
SCHEMBL4724348 0.79 SLC6A2 (0.35) OPRM1
SCHEMBL4721421 0.78 OPRM1 (0.42) OPRM1OPRD1OPRK1OPRL1ALDH1A1
SCHEMBL4720768 0.77 OPRM1 (0.41) OPRM1OPRD1OPRK1OPRL1ALDH1A1
SCHEMBL4724737 0.75 HTR1A (0.38) OPRM1OPRD1OPRK1OPRL1ALDH1A1
SCHEMBL4767382 0.74 OPRM1 (0.36) OPRM1OPRD1OPRK1OPRL1
SCHEMBL6002896 0.74 HTR2A (0.38) OPRM1HTR2A
SCHEMBL4765736 0.72 L3MBTL1 (0.36) ALDH1A1

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 OPRM1 1608/4885OPRD1 776/4885OPRK1 1055/4885

“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.