SCHEMBL6955920

SCHEMBL6955920

CCOC(=O)CC1CCc2cc(NC(=O)c3ccc(NC=NN)cc3)ccc2O1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 13/20 0.58
ITGA2B P08514 13/20 0.58
MAPT P10636 4/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
TSHR P16473 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
PKM P14618 1/20 0.37
MEN1 O00255 1/20 0.37
GLA P06280 1/20 0.37
KMT2A Q03164 1/20 0.37
MITF O75030 1/20 0.37
USP2 O75604 1/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
NTSR1 P30989 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
Hydrochloric Acid SCHEMBL6955164 0.90 ITGB3 (0.56) ITGB3ITGA2BMAPTRAB9ANPC1
SCHEMBL6957699 0.88 ITGB3 (0.74) ITGB3ITGA2B
Hydrochloric Acid SCHEMBL6950435 0.85 ITGB3 (0.75) ITGB3ITGA2BMAPTRAB9ANPC1
SCHEMBL6949063 0.85 ITGB3 (0.56) ITGB3ITGA2BMAPTRAB9ANPC1
SCHEMBL6955908 0.85 ITGB3 (0.66) ITGB3ITGA2BMAPTRAB9ANPC1
Hydrochloric Acid SCHEMBL6958564 0.84 ITGB3 (0.54) ITGB3ITGA2BMAPTRAB9ANPC1
Hydrochloric Acid SCHEMBL6955140 0.84 ITGB3 (0.62) ITGB3ITGA2BMAPTRAB9ANPC1
Hydrochloric Acid SCHEMBL6949261 0.84 ITGB3 (0.53) ITGB3ITGA2BMAPTRAB9ANPC1
SCHEMBL6957431 0.83 ITGB3 (0.52) ITGB3ITGA2BMAPTRAB9ANPC1
Hydrochloric Acid SCHEMBL6957636 0.83 ITGB3 (0.52) ITGB3ITGA2BMAPTRAB9ANPC1

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 6 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

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 294/4885MAPT 4377/4885

“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.