SCHEMBL2652091

SCHEMBL2652091

COC(=O)c1ccc(CNC2CCC(=C3CC3)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.49
LOXL2 Q9Y4K0 1/20 0.47
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
LMNA P02545 2/20 0.45
HPGD P15428 1/20 0.45
CYP4A11 Q02928 2/20 0.44
EPHX1 P07099 1/20 0.44
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYP4F2 P78329 1/20 0.43
CHEK1 O14757 1/20 0.43
GRIN2B Q13224 1/20 0.42
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL2734359 0.90 HDAC1 (0.55) HDAC1LOXL2CA1CA2LMNA
SCHEMBL5070257 0.87 HDAC1 (0.64) HDAC1LOXL2CA1CA2EPHX1
SCHEMBL21088372 0.85 HDAC1 (0.67) HDAC1LOXL2LMNAEPHX1ALDH1A1
SCHEMBL2651787 0.85 HDAC1 (0.51) HDAC1LOXL2CA1CA2LMNA
SCHEMBL2659813 0.84 HDAC1 (0.50) HDAC1LOXL2CA1CA2LMNA
SCHEMBL2659811 0.84 HDAC1 (0.50) HDAC1LOXL2CA1CA2LMNA
SCHEMBL18172649 0.82 HDAC1 (0.48) HDAC1LOXL2CA1CA2LMNA
SCHEMBL2643164 0.82 ALDH1A1 (0.60) HDAC1LOXL2CA1CA2LMNA
SCHEMBL2653241 0.82 LTA4H (0.50) HDAC1LOXL2CA1CA2LMNA
SCHEMBL4092949 0.82 ALDH1A1 (0.60) HDAC1LOXL2CA1CA2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
EP-1183229-B1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK AS (DK) 2005-10-26 EP disclosed
US-20050203108-A1 Glucagon antagonists/inverse agonists PFIZER INC 2005-09-15 US disclosed
US-6875760-B2 Glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2005-04-05 US disclosed
US-20030220350-A1 Glucagon antagonists/inverse agonists PFIZER INC 2003-11-27 US disclosed
US-6503949-B1 Treating Type 2 diabetes, hyperglycemia, impaired glucose tolerance or obesity NORO NORDISK A/S (DK) 2003-01-07 US disclosed
EP-1183229-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-03-06 EP disclosed
WO-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 WO disclosed
WO-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 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 (3 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-20050203108-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR HDAC1 2296/4885LOXL2 3657/4885CA1 4464/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR HDAC1 2296/4885LOXL2 3657/4885CA1 4464/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR HDAC1 2296/4885LOXL2 3657/4885CA1 4464/4885

“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.