SCHEMBL7672956

SCHEMBL7672956

CC(C)(C)N(CCCC=O)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.43
TSHR P16473 2/20 0.42
FAAH O00519 2/20 0.34
TRPV1 Q8NER1 2/20 0.34
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL7678803 0.93 TSHR (0.42) HIF1ATSHRFAAHTRPV1ALDH1A1
SCHEMBL7671376 0.84 ALDH1A1 (0.36) HIF1ATSHRALDH1A1
SCHEMBL13596344 0.77 HIF1A (0.45) HIF1ATSHRFAAHTRPV1
SCHEMBL6657146 0.74
SCHEMBL17555722 0.72 HIF1A (0.35) HIF1ATSHR
SCHEMBL1751213 0.70
SCHEMBL22413407 0.70 TSHR (0.44) HIF1ATSHRFAAHTRPV1ALDH1A1
Bromide SCHEMBL6656732 0.69
Hydrochloric Acid SCHEMBL17550738 0.69
Bromide SCHEMBL17550734 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6380197-B1 FOR TREATING AND PREVENTING A PLETHORA OF DISEASES INCLUDING DIABETES AVENTIS PHARMA S. A. (FR) 2002-04-30 US claimed
EP-1001943-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM Aventis Pharma S.A. (FR) 2000-05-24 EP claimed
WO-1999003843-A1 POLYHYDROXYALKYLPYRAZINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1999-01-28 WO claimed
US-6380197-B1 FOR TREATING AND PREVENTING A PLETHORA OF DISEASES INCLUDING DIABETES AVENTIS PHARMA S. A. (FR) 2002-04-30 US disclosed