SCHEMBL6954015

SCHEMBL6954015

CCOC(=O)CC1CCc2cc(NC(=O)c3ccc(C=NNC(=O)OC)cc3)ccc2O1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.51
ITGA2B P08514 1/20 0.51
KMT2A Q03164 10/20 0.42
MEN1 O00255 9/20 0.40
POLB P06746 4/20 0.40
LMNA P02545 2/20 0.39
MIF P14174 2/20 0.39
RAB9A P51151 5/20 0.38
NPC1 O15118 3/20 0.38
CYP1A2 P05177 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAPT P10636 1/20 0.36

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
SCHEMBL6957431 0.96 ITGB3 (0.52) ITGB3ITGA2BKMT2AMEN1POLB
SCHEMBL6959308 0.93 ITGB3 (0.49) ITGB3ITGA2BKMT2AMEN1POLB
SCHEMBL6954246 0.91 ITGB3 (0.53) ITGB3ITGA2BKMT2AMEN1POLB
SCHEMBL8541201 0.91 ITGB3 (0.63) ITGB3ITGA2BKMT2AMEN1POLB
Hydrochloric Acid SCHEMBL6949261 0.90 ITGB3 (0.53) ITGB3ITGA2BKMT2AMEN1POLB
Hydrochloric Acid SCHEMBL7076506 0.89 ITGB3 (0.52) ITGB3ITGA2BKMT2AMEN1POLB
SCHEMBL6959165 0.88 ITGB3 (0.41) ITGB3ITGA2BKMT2AMEN1POLB
Hydrochloric Acid SCHEMBL6950240 0.88 ITGB3 (0.51) ITGB3ITGA2BKMT2AMEN1POLB
Hydrochloric Acid SCHEMBL6955164 0.87 ITGB3 (0.56) ITGB3ITGA2BKMT2AMEN1LMNA
Hydrochloric Acid SCHEMBL6957967 0.86 ITGB3 (0.49) ITGB3ITGA2BKMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030130342-A1 Glycoprotein llb/llla antagonists FISHER MATTHEW J (US) 2003-07-10 US disclosed
EP-0804431-B9 GLYCOPROTEIN IIb/IIIa ANTAGONISTS LILLY CO ELI (US) 2003-01-02 EP disclosed
US-6448269-B1 SUCH AS 6-(N-(4-(AMINOIMINOMETHYL)BENZOYL)AMINO)-3,4-DIHYDRO-4,4-DIMETHYL-2H-1 -BENZOPYRAN-2-YL)ACETIC ACID; INHIBITING PLATELET AGGREGATION OR FIBRINOGEN BINDING OR PREVENTING THROMBOSIS ELI LILLY AND COMPANY 2002-09-10 US disclosed
EP-0804431-B1 GLYCOPROTEIN IIb/IIIa ANTAGONISTS LILLY CO ELI (US) 2002-07-24 EP disclosed
US-6020362-A ANTICOAGULANTS ELI LILLY AND COMPANY (US) 2000-02-01 US disclosed
US-5731324-A Glycoprotein IIb/IIIa antagonists ELI LILLY AND COMPANY (US) 1998-03-24 US disclosed
WO-1996022288-A1 GLYCOPROTEIN IIb/IIIa ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-07-25 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-20030130342-A1 Glycoprotein llb/llla antagonists SELL, SELPLG, LY96 ITGB3 653/4885ITGA2B 294/4885KMT2A 4422/4885

“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.