SCHEMBL9203522

SCHEMBL9203522

C=CC(C)c1ccccc1P

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.33
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32

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
SCHEMBL7559113 0.84 GABRA1 (0.44) ELANEGABRA1GABRB2
SCHEMBL15914232 0.77 GABRA1 (0.50) ELANEGABRA1GABRB2
SCHEMBL11463024 0.76 ESR1 (0.46) ELANEGABRA1GABRB2
SCHEMBL10410201 0.76 ESR1 (0.46) ELANEGABRA1GABRB2
SCHEMBL10507496 0.74 GABRA1 (0.58) ELANEGABRA1GABRB2
SCHEMBL8113334 0.74 CYP3A4 (0.38) ELANEGABRA1GABRB2
SCHEMBL17417908 0.74 ELANE (0.33) ELANEGABRA1GABRB2
SCHEMBL5334645 0.74 ALDH1A1 (0.32)
SCHEMBL2917292 0.74 GABRA1 (0.50) GABRA1GABRB2
SCHEMBL13122927 0.72 GABRA1 (0.37) GABRA1GABRB2

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-0531174-B1 Oligomerization catalyst for alpha-olefins and process for oligomerizing alpha-olefins MITSUI PETROCHEMICAL IND (JP) 1995-06-21 EP disclosed
US-5286695-A Oligomerization catalyst for α-olefins and process for oligomerizing α-olefins MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-02-15 US disclosed
EP-0531174-A2 Oligomerization catalyst for alpha-olefins and process for oligomerizing alpha-olefins MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-03-10 EP disclosed