SCHEMBL6012035

SCHEMBL6012035

COC(C)OC.O=CCOc1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.41
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
RAB9A P51151 2/20 0.39
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
DRD3 P35462 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NPC1 O15118 1/20 0.37
MAOB P27338 2/20 0.36
MAOA P21397 1/20 0.36
CYP1A2 P05177 1/20 0.36
SIGMAR1 Q99720 2/20 0.35
HPGD P15428 1/20 0.35
SCN4A P35499 2/20 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
SCHEMBL794717 0.86 DRD4 (0.43) PTGS2DRD2DRD4DRD3MAOB
SCHEMBL10944086 0.84 FFAR1 (0.41) PTGS2ALDH1A1MEN1KMT2ARAB9A
SCHEMBL11384928 0.83 ALDH1A3 (0.49) ALDH1A1MEN1KMT2ARAB9AL3MBTL1
SCHEMBL12696325 0.77 TYR (0.47) ALDH1A1MEN1KMT2ARAB9AL3MBTL1
SCHEMBL2726596 0.75 CA12 (0.42) ALDH1A1RAB9AL3MBTL1HPGD
SCHEMBL1951879 0.74 ALDH1A1 (0.52) ALDH1A1DRD2DRD4DRD3MAOB
SCHEMBL28456471 0.74 MEN1 (0.39) PTGS2ALDH1A1MEN1KMT2ARAB9A
SCHEMBL2081426 0.73 HSD17B10 (0.64) ALDH1A1L3MBTL1HPGD
SCHEMBL19692522 0.72 CYP1A2 (0.44) PTGS2ALDH1A1MEN1KMT2ADRD2
SCHEMBL5648390 0.72 PPARG (0.44) ALDH1A1RAB9ANPC1MAOBMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1445251-B1 Aminoacetonitrile derivative, agricultural and horticultural insecticide containing the same, and use thereof NIHON NOHYAKU CO LTD (JP) 2006-12-27 EP disclosed
EP-1445251-A9 Aminoacetonitrile derivative, agricultural and horticultural insecticide containing the same, and use thereof NIHON NOHYAKU CO., LTD. (JP) 2004-11-03 EP disclosed
EP-0953565-B1 Aminoacetonitrile derivative, agricultural and horticultural insecticide containing the same, and use thereof NIHON NOHYAKU CO LTD (JP) 2004-09-08 EP disclosed
EP-1445251-A1 Aminoacetonitrile derivative, agricultural and horticultural insecticitde containing the same, and use thereof NIHON NOHYAKU CO., LTD. (JP) 2004-08-11 EP disclosed
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
US-6239077-B1 PESTICIDES; APPLYING TO PLANTS NIHON NOHYAKU CO., LTD. (JP) 2001-05-29 US disclosed
EP-0953565-A2 Aminoacetonitrile derivative, agricultural and horticultural insecticide containing the same, and use thereof NIHON NOHYAKU CO., LTD. (JP) 1999-11-03 EP 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
US-4511575-A Antidiabetic pyrrolecarboxylic acids PFIZER INC. (US) 1985-04-16 US disclosed
US-4511576-A Antidiabetic pyrrolecarboxylic acids PFIZER INC. (US) 1985-04-16 US disclosed
US-4351843-A LOWERING BLOOD GLUCOSE PFIZER INC. (US) 1982-09-28 US disclosed
US-4282242-A HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1981-08-04 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 (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 PTGS2 3400/4885ALDH1A1 1932/4885MEN1 3139/4885

“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.