SCHEMBL6022704

SCHEMBL6022704

O=C(O)C=Cc1cc(Br)ccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER3 P43115 3/20 0.49
PTGER2 P43116 3/20 0.49
PTGER1 P34995 2/20 0.49
EIF2AK2 P19525 1/20 0.47
CSNK2A2 P19784 1/20 0.47
CSNK2B P67870 1/20 0.47
CSNK2A1 P68400 1/20 0.47
TBXA2R P21731 2/20 0.46
PTGFR P43088 2/20 0.46
PTGIR P43119 2/20 0.46
PTGDR Q13258 2/20 0.46
PTGER4 P35408 1/20 0.46
EGFR P00533 1/20 0.42
MAPT P10636 3/20 0.42
HSP90AA1 P07900 1/20 0.42
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ITGB2 P05107 1/20 0.42
ICAM1 P05362 1/20 0.42
ITGAL P20701 1/20 0.42

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
SCHEMBL6022702 1.00 PTGER3 (0.49) PTGER3PTGER2PTGER1EIF2AK2CSNK2A2
SCHEMBL16634243 0.86 BACE1 (0.47) PTGER3PTGER2PTGER1EIF2AK2CSNK2A2
SCHEMBL16634244 0.86 BACE1 (0.47) PTGER3PTGER2PTGER1EIF2AK2CSNK2A2
SCHEMBL5862648 0.81 EIF2AK2 (0.55) EIF2AK2CSNK2A2CSNK2BCSNK2A1EGFR
SCHEMBL7378645 0.81 PTGER3 (0.55) PTGER3PTGER2PTGER1TBXA2RPTGFR
SCHEMBL29406682 0.81 PTGER3 (0.55) PTGER3PTGER2PTGER1TBXA2RPTGFR
SCHEMBL5862650 0.81 EIF2AK2 (0.55) EIF2AK2CSNK2A2CSNK2BCSNK2A1EGFR
SCHEMBL7378640 0.81 PTGER3 (0.55) PTGER3PTGER2PTGER1TBXA2RPTGFR
SCHEMBL3864311 0.80 ERN1 (0.58) EIF2AK2CSNK2A2CSNK2BCSNK2A1MAPT
SCHEMBL4922283 0.80 TDO2 (0.55) PTGER3PTGER2PTGER1TBXA2RPTGFR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7053071-B2 For therapy of leukemia or other forms of cancer or for treating disease conditions caused by apoptosis of cells THE BURNHAM INSTITUTE (US) 2006-05-30 US disclosed
EP-1456165-A1 INDUCTION OF APOPTOSIS IN CANCER CELLS The Burnham Institute (US) 2004-09-15 EP disclosed
US-20030176506-A1 Induction of apoptosis in cancer cells BURNHAM INSTITUTE FOR MEDICAL RESEARCH 2003-09-18 US disclosed
WO-2003048101-A1 INDUCTION OF APOPTOSIS IN CANCER CELLS THE BURNHAM INSTITUTE (US) 2003-06-12 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-20030176506-A1 Induction of apoptosis in cancer cells MCL1, BAD, BCL2 PTGER3 2883/4885PTGER2 3085/4885PTGER1 2595/4885

“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.