SCHEMBL6736985

SCHEMBL6736985

Cc1oc(Cc2ccccc2)c(C(=O)c2cc(C(C)C)c(O)c(C(C)C)c2)c1C

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.53
GABRB1 P18505 1/20 0.53
BCL2 P10415 2/20 0.44
MCL1 Q07820 2/20 0.44
GAA P10253 2/20 0.40
HTT P42858 2/20 0.40
LMNA P02545 1/20 0.40
LDHA P00338 2/20 0.40
LDHB P07195 2/20 0.40
TRPA1 O75762 1/20 0.40
CNR2 P34972 2/20 0.38
GPR55 Q9Y2T6 2/20 0.38
GLRA1 P23415 1/20 0.38
CYP2C19 P33261 3/20 0.36
CYP2C9 P11712 1/20 0.36
EYA3 Q99504 3/20 0.36
ALOX5 P09917 1/20 0.35

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
SCHEMBL6735552 0.89 GABRA1 (0.46) GABRA1GABRB1BCL2MCL1GAA
SCHEMBL6730807 0.88 GABRA1 (0.42) GABRA1GABRB1BCL2MCL1GAA
SCHEMBL6734499 0.88 GABRA1 (0.42) GABRA1GABRB1BCL2MCL1GAA
SCHEMBL6731441 0.87 GLRA1 (0.43) GABRA1GABRB1GAAHTTLMNA
SCHEMBL6731106 0.84 GABRA1 (0.46) GABRA1GABRB1BCL2MCL1GAA
SCHEMBL6734693 0.83 CYP2C9 (0.43) LMNALDHALDHBCNR2GPR55
SCHEMBL6735279 0.78 PTPN1 (0.52) MCL1GLRA1
SCHEMBL6738738 0.77 CYP2C19 (0.38) LMNAGLRA1CYP2C19
SCHEMBL6735422 0.76 CYP2C19 (0.36) LMNAGLRA1CYP2C19CYP2C9ALOX5
SCHEMBL6736525 0.75 CYP2C19 (0.46) GAAHTTLMNACNR2GPR55

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-6683107-B2 THERAPY OF METABOLISM DISORDERS WYETH 2004-01-27 US disclosed
US-20030073709-A1 Furans, benzofurans, and thiophenes useful in the treatment of insulin resistance and hyperglycemia WYETH 2003-04-17 US disclosed
US-6451845-B1 ANTIDIABETIC AGENTS WYETH 2002-09-17 US disclosed
US-20020035272-A1 Furans, benzofurans, and thiophenes useful in the treatment of insulin resistance and hyperglycemia AMERICAN HOME PRODUCTS CORPORATION 2002-03-21 US disclosed
US-6248764-B1 ANTIDIABETIC AGENT; HYPOGLYCEMIC AGENT AMERICAN HOME PRODUCTS CORPORATION 2001-06-19 US disclosed
US-6103708-A USEFUL IN TREATING METABOLIC DISORDERS RELATED TO INSULIN RESISTANCE OR HYPERGLYCEMIA AMERICAN HOME PRODUCTS CORPORATION (US) 2000-08-15 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 (2 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-20030073709-A1 Furans, benzofurans, and thiophenes useful in the treatment of insulin resistance and hyperglycemia GPR119, INSR, FFAR3 GABRA1 549/4885GABRB1 174/4885BCL2 1402/4885
US-20020035272-A1 Furans, benzofurans, and thiophenes useful in the treatment of insulin resistance and hyperglycemia INSR, GPR119, FFAR3 GABRA1 682/4885GABRB1 215/4885BCL2 1303/4885

“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.