SCHEMBL20267771

SCHEMBL20267771

C=C1C=CC=C1c1ccccc1C(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA12 O43570 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ GABRA1 P14867 2/20 0.35
▸ GABRB2 P47870 2/20 0.35
▸ FAAH O00519 2/20 0.33
▸ MGLL Q99685 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ GABRB1 P18505 1/20 0.32
▸ GABRG2 P18507 1/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ GABRB3 P28472 1/20 0.32
▸ GABRA5 P31644 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
SCHEMBL8835212 0.76 NPC1 (0.35) CA1CA2CA12CA9HPGD
SCHEMBL19553740 0.71 APP (0.43) CA1CA2CA12CA9LMNA
SCHEMBL167078 0.71 GABRA1 (0.55) CA1CA2CA12CA9GABRA1
SCHEMBL29414063 0.71 GABRA1 (0.55) CA1CA2CA12CA9GABRA1
SCHEMBL9174922 0.69 GABRA1 (0.52) CA1CA2CA12CA9GABRA1
Hydrogen Peroxide SCHEMBL9644435 0.67 GABRA1 (0.56) CA1CA2CA12CA9GABRA1
SCHEMBL146177 0.63 CA1 (0.58) CA1CA2CA12CA9GABRA1
Benzene SCHEMBL28765069 0.63 CA1 (0.58) CA1CA2CA12CA9GABRA1
SCHEMBL29613123 0.63 CA1 (0.58) CA1CA2CA12CA9GABRA1
SCHEMBL27706436 0.63 ALDH1A1 (0.41) CA1CA2FAAHMGLLCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110234665-B Catalyst system for preparing polyethylene copolymers in high temperature solution polymerization process 博里利斯股份公司 2022-05-24 — — CN disclosed
EP-3555148-A1 CATALYST SYSTEM FOR PRODUCING POLYETHYLENE COPOLYMERS IN A HIGH TEMPERATURE SOLUTION POLYMERIZATION PROCESS Borealis AG (AT) 2019-10-23 — — EP disclosed
EP-3555149-A1 NEW CATALYST SYSTEM FOR PRODUCING POLYETHYLENE COPOLYMERS IN A HIGH TEMPERATURE SOLUTION POLYMERIZATION PROCESS Borealis AG (AT) 2019-10-23 — — EP disclosed
WO-2018108918-A1 CATALYST SYSTEM FOR PRODUCING POLYETHYLENE COPOLYMERS IN A HIGH TEMPERATURE SOLUTION POLYMERIZATION PROCESS BOREALIS AG (AT) 2018-06-21 — — WO disclosed
WO-2018108917-A1 NEW CATALYST SYSTEM FOR PRODUCING POLYETHYLENE COPOLYMERS IN A HIGH TEMPERATURE SOLUTION POLYMERIZATION PROCESS BOREALIS AG (AT) 2018-06-21 — — WO disclosed
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