SCHEMBL5430748

SCHEMBL5430748

CCOC(=O)c1cn(C2CC2)c2ccc(C#CCNC(=O)OC(C)(C)C)cc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 2/20 0.41
CRBN Q96SW2 2/20 0.41
PTPN11 Q06124 1/20 0.41
LMNA P02545 2/20 0.39
ADRB2 P07550 1/20 0.39
HPGD P15428 5/20 0.39
ADRA2A P08913 1/20 0.37
DRD5 P21918 1/20 0.37
DRD3 P35462 1/20 0.37
P2RY6 Q15077 1/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
MAPT P10636 2/20 0.37
THRB P10828 1/20 0.37
GAPDH P04406 1/20 0.36
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HSD17B10 Q99714 3/20 0.35
POLB P06746 1/20 0.33

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
SCHEMBL5678773 0.87 ADRB2 (0.41) LMNAADRB2HPGDKMT2AMEN1
SCHEMBL3974096 0.86 LMNA (0.56) DDB1CRBNPTPN11LMNAHPGD
SCHEMBL4179988 0.85 PTPN11 (0.42) DDB1CRBNPTPN11LMNAHPGD
SCHEMBL5434373 0.81 ADRB2 (0.46) DDB1CRBNLMNAADRB2HPGD
SCHEMBL4171045 0.81 DDB1 (0.40) DDB1CRBNPTPN11LMNAHPGD
SCHEMBL4183925 0.78 DDB1 (0.37) DDB1CRBNPTPN11LMNAADRB2
SCHEMBL4164845 0.77 GABRA1 (0.55) DDB1CRBNPTPN11HPGDKMT2A
SCHEMBL3815499 0.76 LMNA (0.50) DDB1CRBNLMNAHPGDKMT2A
SCHEMBL5442448 0.75 DDB1 (0.42) DDB1CRBNPTPN11LMNAADRB2
SCHEMBL3291116 0.75 LMNA (0.37) DDB1CRBNPTPN11LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070293472-A1 Novel 14 and 15 Membered Ring Compounds GLAXO GROUP LIMITED (GB) 2007-12-20 US disclosed
EP-1628989-B1 NOVEL 14 AND 15 MEMBERED-RING COMPOUNDS GLAXO GROUP LTD (GB) 2006-12-20 EP 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-20070293472-A1 Novel 14 and 15 Membered Ring Compounds IL17A, CYP51A1, IL15 DDB1 3868/4885CRBN 3155/4885PTPN11 1610/4885

“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.