SCHEMBL6824704

SCHEMBL6824704

c1cc(-c2ccsc2)c2oc(C3=NCCN3)cc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 5/20 0.51
ADRA2A P08913 4/20 0.51
ADRA2B P18089 4/20 0.51
ADRA2C P18825 4/20 0.51
ALDH1A1 P00352 2/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2D6 P10635 2/20 0.51
HSD17B10 Q99714 2/20 0.51
MAOB P27338 2/20 0.51
KDM4E B2RXH2 1/20 0.51
HPGD P15428 1/20 0.51
MAOA P21397 1/20 0.51
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
TMIGD3 P0DMS9 2/20 0.42
ADORA2A P29274 2/20 0.42
ADORA1 P30542 1/20 0.42
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39

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
Hydrochloric Acid SCHEMBL7736199 0.99 NISCH (0.50) NISCHADRA2AADRA2BADRA2CALDH1A1
SCHEMBL6824232 0.81 NISCH (0.53) NISCHADRA2AADRA2BADRA2CALDH1A1
Hydrochloric Acid SCHEMBL7736782 0.81 NISCH (0.51) NISCHADRA2AADRA2BADRA2CALDH1A1
Hydrochloric Acid SCHEMBL7738742 0.80 LMNA (0.52) NISCHADRA2AADRA2BADRA2CALDH1A1
SCHEMBL6826787 0.80 NISCH (0.58) NISCHADRA2AADRA2BADRA2CALDH1A1
Hydrochloric Acid SCHEMBL7736812 0.80 NISCH (0.52) NISCHADRA2AADRA2BADRA2CALDH1A1
Hydrochloric Acid SCHEMBL7727914 0.80 NISCH (0.52) NISCHADRA2AADRA2BADRA2CALDH1A1
Hydrochloric Acid SCHEMBL7736140 0.79 NISCH (0.57) NISCHADRA2AADRA2BADRA2CALDH1A1
Hydrochloric Acid SCHEMBL7736197 0.79 NISCH (0.58) NISCHADRA2AADRA2BADRA2CALDH1A1
Hydrochloric Acid SCHEMBL7736342 0.77 NISCH (0.53) NISCHADRA2AADRA2BADRA2CALDH1A1

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 10 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
US-6410562-B1 ANTIDIABETIC AGENTS ELI LILLY AND COMPANY 2002-06-25 US 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
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 277/4885ADRA2A 1004/4885ADRA2B 964/4885

“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.