SCHEMBL4919285

SCHEMBL4919285

CCCCOc1[c]occ1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 7/20 0.41
CYP2C9 P11712 6/20 0.41
CYP2C19 P33261 6/20 0.41
CYP2D6 P10635 5/20 0.41
CYP19A1 P11511 4/20 0.41
LTA4H P09960 4/20 0.37
NR5A1 Q13285 1/20 0.36
CYP3A4 P08684 3/20 0.35
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA7 P43166 2/20 0.34
CA9 Q16790 2/20 0.34
TSHR P16473 2/20 0.34
MAPK1 P28482 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
HTR2A P28223 1/20 0.34
SCN1A P35498 1/20 0.34

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
SCHEMBL4919655 0.90
SCHEMBL4765642 0.70 CYP1A2 (0.50) CYP1A2CYP2C9CYP2C19CYP2D6CYP19A1
SCHEMBL677726 0.68 LTA4H (0.45) CYP1A2CYP2C9CYP2C19CYP2D6CYP19A1
SCHEMBL10692851 0.67 LTA4H (0.46) CYP1A2CYP2C9CYP2C19CYP2D6CYP19A1
SCHEMBL4063778 0.67 LTA4H (0.39) CYP1A2CYP2C9CYP2C19CYP2D6CYP19A1
SCHEMBL2454500 0.67
SCHEMBL1478006 0.65 KMT2A (0.44) CYP1A2CYP2C19MAPK1ALDH1A1LMNA
SCHEMBL26850 0.65 LTA4H (0.70) CYP1A2CYP2C9CYP2C19CYP2D6CYP19A1
SCHEMBL3335296 0.64 CYP1A2 (0.41) CYP1A2CYP2C9CYP2C19LTA4HNR5A1
SCHEMBL2966529 0.64 PTGS2 (0.38) CYP1A2CYP2C9CYP2C19CYP2D6CYP3A4

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 CYP1A2 578/4885CYP2C9 648/4885CYP2C19 393/4885

“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.