SCHEMBL7086030

SCHEMBL7086030

CCCCCCCCCCCCCCCCCCC1CCCc2ccccc21

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.56
BCHE P06276 1/20 0.52
CYP19A1 P11511 1/20 0.49
TBXAS1 P24557 1/20 0.49

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
SCHEMBL28543868 1.00 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL29028262 1.00 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL28544041 1.00 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL28812914 1.00 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL28812842 1.00 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL30496006 1.00 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL29117087 1.00 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL1760674 1.00 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL28544038 1.00 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1
SCHEMBL28553249 1.00 SIGMAR1 (0.56) SIGMAR1BCHECYP19A1TBXAS1

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
WO-2003064102-A1 SOLDER METAL, SOLDERING FLUX AND SOLDER PASTE SHOWA DENKO K.K. (JP) 2003-08-07 WO disclosed
EP-0033435-A2 Use of alkylcyclohexane as essential ingredient of lubricating oils for combustion engines BASF Aktiengesellschaft (DE) 1981-08-12 EP disclosed