SCHEMBL4889338

SCHEMBL4889338

[CH2]CCCC(=O)NCCCO

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.47
NAAA Q02083 1/20 0.47
TSHR P16473 2/20 0.44
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
DNM1 Q05193 1/20 0.42
CASP2 P42575 1/20 0.41
FAAH O00519 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SELP P16109 1/20 0.38

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
SCHEMBL4894922 0.94 NAAA (0.50) CNR1NAAATSHRTP53MAPK1
SCHEMBL7557352 0.92 NAAA (0.48) CNR1NAAATSHRDNM1CASP2
SCHEMBL29113529 0.91 NAAA (0.47) CNR1NAAATSHRTP53MAPK1
SCHEMBL2401231 0.89 CNR1 (0.47) CNR1NAAAFAAHMAPTMEN1
SCHEMBL1416033 0.89 NAAA (0.48) CNR1NAAATSHRTP53MAPK1
SCHEMBL29113511 0.88 NAAA (0.48) CNR1NAAATSHRDNM1CASP2
SCHEMBL620134 0.86 NAAA (0.54) CNR1NAAATSHRTP53MAPK1
SCHEMBL9717404 0.86 TSHR (0.56) CNR1NAAATSHRTP53MAPK1
SCHEMBL6940499 0.86 NAAA (0.54) CNR1NAAATSHRTP53MAPK1
SCHEMBL14984043 0.84 NAAA (0.57) CNR1NAAATSHRDNM1CASP2

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-20080194590-A1 4-Piperazinylthieno [2,3-D] Pyrimidine Compounds as Platelet Aggregation Inhibitors PFIZER INC 2008-08-14 US disclosed
EP-1869051-A1 4-PIPERAZINYLTHIENO Ý2,3-D¨PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS Pharmacia & Upjohn Company LLC (US) 2007-12-26 EP disclosed
WO-2006103545-A1 4-PIPERAZINYLTHIENO [2,3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-10-05 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-20080194590-A1 4-Piperazinylthieno [2,3-D] Pyrimidine Compounds as Platelet Aggregation Inhibitors PFKP, PF4, P2RY4 CNR1 819/4885NAAA 2835/4885TSHR 1355/4885

“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.