SCHEMBL11078720

SCHEMBL11078720

COC(=O)C(Cl)Cc1ccc(OCC2CCC(=O)CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACACB O00763 9/20 0.47
P2RX3 P56373 7/20 0.42
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41
PPARA Q07869 1/20 0.41
PARP15 Q460N3 1/20 0.40
PARP10 Q53GL7 1/20 0.40
PARP2 Q9UGN5 1/20 0.40

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
SCHEMBL11088655 0.82 ACACB (0.41) ACACBP2RX3PPARGPPARDPPARA
SCHEMBL11088648 0.78 ACACB (0.48) ACACBPPARGPPARDPPARA
Hydrochloric Acid SCHEMBL3500467 0.75 ACACB (0.57) ACACBPARP15PARP10PARP2
Hydrochloric Acid SCHEMBL3500469 0.75 ACACB (0.57) ACACBPARP15PARP10PARP2
SCHEMBL5672844 0.74 LDHA (0.59) ACACBPPARGPPARA
SCHEMBL7104359 0.73 PARP10 (0.54) ACACBPARP15PARP10PARP2
SCHEMBL11084088 0.73 THRB (0.50) ACACBPPARGPPARDPPARA
Hydrochloric Acid SCHEMBL3498383 0.72 PARP10 (0.53) ACACBPARP15PARP10PARP2
Hydrochloric Acid SCHEMBL3498380 0.72 PARP10 (0.53) ACACBPARP15PARP10PARP2
SCHEMBL11084084 0.72 ACACB (0.43) ACACBPPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4461902-A BLOOD LIPID AND SUGAR LOWERING AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-07-24 US disclosed
EP-0084926-A1 Thiazolidine derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1983-08-03 EP disclosed