SCHEMBL6954243

SCHEMBL6954243

CCOC(=O)CC1CCc2cc(NC(=O)c3ccc(C(=N)NC(=O)c4ccccc4)cc3)ccc2O1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 7/20 0.60
ITGA2B P08514 7/20 0.60
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
GAA P10253 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
GLA P06280 1/20 0.40
MAPT P10636 1/20 0.40
MCHR1 Q99705 2/20 0.39
MAPK14 Q16539 1/20 0.39
TP53 P04637 1/20 0.39
NFKB1 P19838 1/20 0.39
HTT P42858 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
TMPRSS2 O15393 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
SCHEMBL6957424 0.91 ITGB3 (0.59) ITGB3ITGA2BNPC1RAB9ASMN1; SMN2
SCHEMBL6954012 0.91 ITGB3 (0.59) ITGB3ITGA2BNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL6949257 0.89 ITGB3 (0.60) ITGB3ITGA2BNPC1RAB9ASMN1; SMN2
SCHEMBL6959301 0.88 ITGB3 (0.56) ITGB3ITGA2BNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL7076499 0.88 ITGB3 (0.59) ITGB3ITGA2BNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL6955140 0.87 ITGB3 (0.62) ITGB3ITGA2BNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL6950239 0.86 ITGB3 (0.57) ITGB3ITGA2BNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL6950435 0.86 ITGB3 (0.75) ITGB3ITGA2BNPC1RAB9AL3MBTL1
SCHEMBL6955908 0.86 ITGB3 (0.66) ITGB3ITGA2BNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL6957966 0.85 ITGB3 (0.56) ITGB3ITGA2BNPC1RAB9ASMN1; SMN2

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 294/4885NPC1 2274/4885

“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.