SCHEMBL4919973

SCHEMBL4919973

CC[CH]NC(=O)OC(C)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.51
OPRM1 P35372 3/20 0.45
LPAR1 Q92633 3/20 0.44
LPAR3 Q9UBY5 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LTB4R Q15722 4/20 0.42
LTB4R2 Q9NPC1 4/20 0.42
CTSK P43235 2/20 0.41
NAAA Q02083 1/20 0.41
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL4924887 0.89 HCAR2 (0.48) HCAR2OPRM1LPAR1LPAR3MEN1
SCHEMBL4910822 0.83 HCAR2 (0.54) HCAR2OPRM1LPAR1LPAR3MEN1
SCHEMBL4910200 0.83 KMT2A (0.43) HCAR2MEN1KMT2ACTSKPOLB
SCHEMBL1059565 0.82 HCAR2 (0.53) HCAR2OPRM1LPAR1LPAR3MEN1
SCHEMBL1059944 0.82 HCAR2 (0.53) HCAR2OPRM1LPAR1LPAR3MEN1
SCHEMBL4919039 0.80 PPARG (0.41) MEN1KMT2ACTSKPOLB
SCHEMBL10638831 0.80 OPRM1 (0.53) HCAR2OPRM1LPAR1LPAR3MEN1
SCHEMBL10152007 0.78 HCAR2 (0.54) HCAR2OPRM1LPAR1LPAR3KMT2A
SCHEMBL12125431 0.78 HCAR2 (0.54) HCAR2OPRM1LPAR1LPAR3KMT2A
SCHEMBL8290955 0.78 HCAR2 (0.54) HCAR2OPRM1LPAR1LPAR3KMT2A

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-20080200475-A1 4-Piperazinothieno[2,3-D] Pyrimidine Compounds As Platelet Aggregation Inhibitors PFIZER INC. 2008-08-21 US disclosed
EP-1866317-A1 4-PIPERAZINOTHIENO [2, 3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS Pharmacia & Upjohn Company LLC (US) 2007-12-19 EP disclosed
WO-2006103555-A1 4-PIPERAZINOTHIENO [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-20080200475-A1 4-Piperazinothieno[2,3-D] Pyrimidine Compounds As Platelet Aggregation Inhibitors PF4, TBXA2R, P2RY4 HCAR2 2451/4885OPRM1 1746/4885LPAR1 509/4885

“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.