SCHEMBL7614010

SCHEMBL7614010

O=C(O)C(Cl)(Cl)CCCCCl

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
ACLY P53396 1/20 0.34
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33
FFAR1 O14842 1/20 0.30
CPT2 P23786 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL7619935 0.98 ACLY (0.38) TSHRALDH1A1TP53ACLYACACB
SCHEMBL9620703 0.89 TSHR (0.44) TSHRALDH1A1TP53ACLYACACB
SCHEMBL9620785 0.87 ACLY (0.43) TSHRALDH1A1TP53ACLYACACB
SCHEMBL9620360 0.87 ACLY (0.43) TSHRALDH1A1TP53ACLYACACB
SCHEMBL9060464 0.87 ACLY (0.43) TSHRALDH1A1TP53ACLYACACB
SCHEMBL9620660 0.87 ACLY (0.43) TSHRALDH1A1TP53ACLYACACB
SCHEMBL11386150 0.81
SCHEMBL2207815 0.78 FDPS (0.43) TSHRALDH1A1FFAR1TDP1
SCHEMBL10870601 0.78 ACLY (0.57) TSHRACLYACACBACACAFFAR1
SCHEMBL10872185 0.76 ACLY (0.61) TSHRACLYACACBACACAFFAR1

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
EP-0790824-B1 2,2-DICHLOROALKANE CARBOXYLIC ACIDS, PROCESS FOR PREPARING THE SAME, MEDICAMENT CONTAINING THE SAME, AND USE THEREOF FOR TREATING INSULIN RESISTANCE ROCHE DIAGNOSTICS GMBH (DE) 2002-02-06 EP disclosed
US-5968982-A TREATMENT OF DIABETES ROCHE DIAGNOSTICS GMBH (DE) 1999-10-19 US disclosed
EP-0790824-A1 2,2-DICHLOROALKANE CARBOXYLIC ACIDS, PROCESS FOR PREPARING THE SAME, MEDICAMENT CONTAINING THE SAME, AND USE THEREOF FOR TREATING INSULIN RESISTANCE Roche Diagnostics GmbH (DE) 1997-08-27 EP disclosed
WO-1996015784-A2 2,2-DICHLOROALKANE CARBOXYLIC ACIDS, PROCESS FOR PREPARING THE SAME, MEDICAMENT CONTAINING THE SAME, AND USE THEREOF FOR TREATING INSULIN RESISTANCE BOEHRINGER MANNHEIM GMBH (DE) 1996-05-30 WO disclosed