SCHEMBL6824313

SCHEMBL6824313

O=C(O)c1c(C(F)(F)F)[nH]c2ccc(C(F)(F)F)cc12

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
KDM4E B2RXH2 2/20 0.49
KIF11 P52732 8/20 0.49
MAPK1 P28482 1/20 0.47
MAP2K4 P45985 1/20 0.47
MAPKAPK3 Q16644 1/20 0.47
MAPK6 Q16659 1/20 0.47
MPL P40238 1/20 0.45
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
CYP1A2 P05177 1/20 0.43
ALOX12 P18054 1/20 0.43
CHUK O15111 1/20 0.43
HSD17B10 Q99714 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
SCHEMBL6820868 0.86 MEN1 (0.55) MEN1KMT2AKDM4EKIF11MAPK1
SCHEMBL28207446 0.83 KDM4E (0.50) MEN1KMT2AKDM4EKIF11MAPK1
SCHEMBL28207454 0.83 MAP2 (0.47) MEN1KMT2AKDM4EMAPK1HPGD
SCHEMBL28206987 0.81 KIF11 (0.47) MEN1KMT2AKDM4EKIF11ALDH1A1
SCHEMBL28206996 0.80 ALDH1A1 (0.53) MEN1KMT2AKDM4EMAPK1ALDH1A1
SCHEMBL28207430 0.80 KDM4E (0.53) MEN1KMT2AKDM4EKIF11
SCHEMBL1115219 0.80 L3MBTL1 (0.53) MEN1KMT2ACHUK
SCHEMBL28062757 0.80 ALDH1A1 (0.42) MEN1KMT2AKDM4EKIF11MAPK1
SCHEMBL6824483 0.79 MEN1 (0.54) MEN1KMT2AKDM4EKIF11MAPK1
SCHEMBL26250360 0.79 KDM4E (0.57) MEN1KMT2AKDM4EKIF11MAPK1

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-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 MEN1 3139/4885KMT2A 3944/4885KDM4E 2605/4885

“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.