SCHEMBL8039434

SCHEMBL8039434

CCCCC[C]1CC(C)OCCO1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.34
EPHX1 P07099 1/20 0.32
ALDH1A1 P00352 1/20 0.31
EBP Q15125 1/20 0.30
SIGMAR1 Q99720 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
SCHEMBL11502209 0.87
SCHEMBL2049887 0.75 SMN1; SMN2 (0.41) CYP1A2EPHX1ALDH1A1EBPSIGMAR1
SCHEMBL11869766 0.75 SMN1; SMN2 (0.41) CYP1A2EPHX1ALDH1A1EBPSIGMAR1
SCHEMBL460853 0.75 SMN1; SMN2 (0.41) CYP1A2EPHX1ALDH1A1EBPSIGMAR1
SCHEMBL6130975 0.75 SMN1; SMN2 (0.41) CYP1A2EPHX1ALDH1A1EBPSIGMAR1
SCHEMBL168713 0.70 TSHR (0.38) CYP1A2EPHX1ALDH1A1
SCHEMBL2868810 0.70 TSHR (0.38) CYP1A2EPHX1ALDH1A1
SCHEMBL11304936 0.70 TSHR (0.38) CYP1A2EPHX1ALDH1A1
SCHEMBL449800 0.70 TSHR (0.38) CYP1A2EPHX1ALDH1A1
SCHEMBL5597049 0.70 TSHR (0.38) CYP1A2EPHX1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0846154-B1 USE OF PORTION PACKED POWDERED LOW ALKALINE ENZYMATIC DETERGENT ON DAIRY FARMS UNILEVER NV (NL) 2000-04-12 EP claimed
EP-0846154-A1 USE OF PORTION PACKED POWDERED LOW ALKALINE ENZYMATIC DETERGENT ON DAIRY FARMS UNILEVER N.V. (NL) 1998-06-10 EP claimed
WO-1997007190-A1 USE OF PORTION PACKED POWDERED LOW ALKALINE ENZYMATIC DETERGENT ON DAIRY FARMS UNILEVER N.V. (NL) 1997-02-27 WO claimed
EP-0846154-B1 USE OF PORTION PACKED POWDERED LOW ALKALINE ENZYMATIC DETERGENT ON DAIRY FARMS UNILEVER NV (NL) 2000-04-12 EP disclosed
EP-0846154-B1 USE OF PORTION PACKED POWDERED LOW ALKALINE ENZYMATIC DETERGENT ON DAIRY FARMS UNILEVER NV (NL) 2000-04-12 EP disclosed
EP-0846154-A1 USE OF PORTION PACKED POWDERED LOW ALKALINE ENZYMATIC DETERGENT ON DAIRY FARMS UNILEVER N.V. (NL) 1998-06-10 EP disclosed
EP-0846154-A1 USE OF PORTION PACKED POWDERED LOW ALKALINE ENZYMATIC DETERGENT ON DAIRY FARMS UNILEVER N.V. (NL) 1998-06-10 EP disclosed
WO-1997007190-A1 USE OF PORTION PACKED POWDERED LOW ALKALINE ENZYMATIC DETERGENT ON DAIRY FARMS UNILEVER N.V. (NL) 1997-02-27 WO disclosed
WO-1997007190-A1 USE OF PORTION PACKED POWDERED LOW ALKALINE ENZYMATIC DETERGENT ON DAIRY FARMS UNILEVER N.V. (NL) 1997-02-27 WO disclosed