SCHEMBL4656142

SCHEMBL4656142

CCOC(=O)c1cn(CCCNC(=O)OC(C)(C)C)c2cc(Br)ccc2c1=O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
CAMK2D Q13557 3/20 0.48
CNR2 P34972 4/20 0.48
CNR1 P21554 3/20 0.47
P2RX3 P56373 1/20 0.42
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRA3 P34903 1/20 0.41
GABRB2 P47870 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.40
PRPS1 P60891 1/20 0.40
DYRK1A Q13627 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
CPB2 Q96IY4 1/20 0.38
POLB P06746 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
SCHEMBL6073363 0.89 CAMK2D (0.51) CAMK2DCNR2CNR1PRPS1DYRK1A
SCHEMBL4653711 0.88 P2RX3 (0.41) LMNACAMK2DCNR2CNR1P2RX3
SCHEMBL4654813 0.87 KMT2A (0.44) LMNACAMK2DCNR2CNR1P2RX3
SCHEMBL3003325 0.81 LMNA (0.67) LMNACAMK2DCNR2CNR1P2RX3
SCHEMBL29324305 0.81 CNR1 (0.48) LMNACAMK2DCNR2CNR1P2RX3
SCHEMBL2995302 0.80 LMNA (0.66) LMNACAMK2DCNR2CNR1P2RX3
SCHEMBL3768764 0.79 LMNA (0.82) LMNAP2RX3GABRA1GABRB1GABRA3
SCHEMBL5665792 0.79 LMNA (0.52) LMNACNR2CNR1P2RX3GABRA1
SCHEMBL2995269 0.78 LMNA (0.64) LMNACAMK2DCNR2CNR1P2RX3
SCHEMBL8733605 0.78 STAT3 (0.45) LMNACAMK2DKMT2ATDP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1307226-B1 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS LANTHEUS MEDICAL IMAGING INC (US) 2008-11-19 EP disclosed
EP-1423152-A4 SIMULTANEOUS IMAGING OF CARDIAC PERFUSION AND A VITRONECTIN RECEPTOR TARGETED IMAGING AGENT BRISTOL MYERS SQUIBB PHARMA CO (US) 2006-12-27 EP disclosed
US-7138104-B2 Simultaneous imaging of cardiac perfusion and a vitronectin receptor targeted imaging agent BRISTOL-MYERS SQUIBB COMPANY (US) 2006-11-21 US disclosed
CN-1582166-A Vitronectin receptor antagonist pharmaceuticals for use in combination therapy BRISTOL MYERS SQUIBB PHARMA CO (US) 2005-02-16 CN disclosed
EP-1423152-A2 SIMULTANEOUS IMAGING OF CARDIAC PERFUSION AND A VITRONECTIN RECEPTOR TARGETED IMAGING AGENT Bristol-Myers Squibb Pharma Company (US) 2004-06-02 EP disclosed
EP-1307226-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS Bristol-Myers Squibb Pharma Company (US) 2003-05-07 EP disclosed
WO-2003013346-A2 SIMULTANEOUS IMAGING OF CARDIAC PERFUSION AND A VITRONECTIN RECEPTOR TARGETED IMAGING AGENT BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2003-02-20 WO disclosed
CN-1356913-A vitronectin receptor antagonist drugs DU PONT PHARM CO (US) 2002-07-03 CN disclosed
US-20020041878-A1 Vitronectin receptor antagonist pharmaceuticals LANTHEUS MEDICAL IMAGING, INC. 2002-04-11 US disclosed
WO-2001097848-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-12-27 WO disclosed
EP-1140204-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS Du Pont Pharmaceuticals Company (US) 2001-10-10 EP disclosed
WO-2000035492-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS DU PONT PHARMACEUTICALS COMPANY (US) 2000-06-22 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-20020041878-A1 Vitronectin receptor antagonist pharmaceuticals ADGRF1, RXFP1, VCAM1 LMNA 174/4885CAMK2D 1359/4885CNR2 106/4885

“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.