SCHEMBL9010969

SCHEMBL9010969

O=C(O)CC1=CCCC(CCO)C1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
BRD4 O60885 1/20 0.31
ESR2 Q92731 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
SCHEMBL9010832 0.90
SCHEMBL9010854 0.73 ALDH1A1 (0.33) ESR2
SCHEMBL18465807 0.69 ESR2 (0.34) BRD4ESR2
SCHEMBL18465799 0.69 ESR2 (0.34) BRD4ESR2
SCHEMBL5864382 0.69 BRD4 (0.35) BRD4ESR2
SCHEMBL12622484 0.69 BRD4 (0.33) BRD4ESR2
SCHEMBL30288516 0.68 PNMT (0.35) BRD4ESR2
SCHEMBL9010968 0.68 SLC6A12 (0.32)
SCHEMBL16887492 0.67 THRA (0.32) THRATHRB
SCHEMBL16887450 0.67 THRA (0.32) THRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0477983-B1 Unsaturated polylactone acrylates and derivatives thereof UNION CARBIDE CHEM PLASTIC (US) 1996-11-13 EP disclosed
US-5557007-A Unsaturated polylactone acrylates and derivatives thereof UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1996-09-17 US disclosed
EP-0477983-A2 Unsaturated polylactone acrylates and derivatives thereof UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) 1992-04-01 EP disclosed