SCHEMBL6824657

SCHEMBL6824657

COCCOc1c(C2=NCCN2)cc2cc(-c3ccsc3)ccc2c1Cl

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 3/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
CD274 Q9NZQ7 6/20 0.35
PDCD1LG2 Q9BQ51 5/20 0.35
ADRA2A P08913 3/20 0.33
ADRA2B P18089 3/20 0.33
ADRA2C P18825 3/20 0.33
PDCD1 Q15116 1/20 0.33
CHEK1 O14757 1/20 0.33
CYP2A6 P11509 1/20 0.32

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
SCHEMBL6820993 0.88 LMNA (0.42) NISCHCD274PDCD1LG2
SCHEMBL6820859 0.87 NISCH (0.42) NISCHCD274PDCD1LG2PDCD1
SCHEMBL6826683 0.83 NISCH (0.36) NISCHCD274PDCD1LG2PDCD1
SCHEMBL6826510 0.83 NISCH (0.52) NISCHCD274PDCD1LG2PDCD1
SCHEMBL6824124 0.83 NISCH (0.45) NISCHADRA1ACD274PDCD1LG2PDCD1
SCHEMBL6824002 0.82 NISCH (0.43) NISCHADRA1DADRA1AADRA1BADRA2A
SCHEMBL6825218 0.81 KCNH2 (0.43) NISCHCD274PDCD1LG2PDCD1
Hydrochloric Acid SCHEMBL7735616 0.81 NISCH (0.42) NISCHADRA1DADRA1AADRA1BADRA2A
Hydrochloric Acid SCHEMBL7738758 0.81 KCNH2 (0.43) NISCHCD274PDCD1LG2PDCD1
Hydrochloric Acid SCHEMBL8197454 0.79 ADRA1D (0.45) NISCHADRA1DADRA1AADRA1BADRA2A

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-20040009976-A1 Hypoglycemic imidazoline compounds TAKEUCHI KUMIKO (US) 2004-01-15 US claimed
EP-0924209-B1 Hypoglycemic imidazoline compounds LILLY CO ELI (US) 2003-05-02 EP claimed
EP-1266897-A2 Hypoglycemic imidazoline compounds ELI LILLY AND COMPANY (US) 2002-12-18 EP claimed
WO-1999032482-A1 HYPOGLYCEMIC IMIDAZOLINE COMPOUNDS ELI LILLY AND COMPANY (US) 1999-07-01 WO claimed
EP-0924209-A1 Hypoglycemic imidazoline compounds ELI LILLY AND COMPANY (US) 1999-06-23 EP claimed
US-20040009976-A1 Hypoglycemic imidazoline compounds TAKEUCHI KUMIKO (US) 2004-01-15 US disclosed
EP-0924209-B1 Hypoglycemic imidazoline compounds LILLY CO ELI (US) 2003-05-02 EP disclosed
EP-1266897-A2 Hypoglycemic imidazoline compounds ELI LILLY AND COMPANY (US) 2002-12-18 EP disclosed
US-6410562-B1 ANTIDIABETIC AGENTS ELI LILLY AND COMPANY 2002-06-25 US disclosed
WO-1999032482-A1 HYPOGLYCEMIC IMIDAZOLINE COMPOUNDS ELI LILLY AND COMPANY (US) 1999-07-01 WO disclosed
EP-0924209-A1 Hypoglycemic imidazoline compounds ELI LILLY AND COMPANY (US) 1999-06-23 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-20040009976-A1 Hypoglycemic imidazoline compounds GPR119, IAPP, GLP1R NISCH 277/4885ADRA1D 607/4885ADRA1A 828/4885

“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.