SCHEMBL5698312

SCHEMBL5698312

CC(Br)c1cccc2c1C=CC2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.36
FAAH O00519 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
GABRA1 P14867 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
GABRB1 P18505 1/20 0.30
GABRG2 P18507 1/20 0.30
PTGS1 P23219 1/20 0.30
SLC6A2 P23975 1/20 0.30
HTR2C P28335 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30
GABRA3 P34903 1/20 0.30
HTR2B P41595 1/20 0.30
GABRA2 P47869 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
SCHEMBL7186336 0.84 CA1 (0.32) FAAHCA1CA2LMNACYP1A2
SCHEMBL6909918 0.84 GABRA1 (0.41) FAAHCA1CA2LMNACYP1A2
SCHEMBL29734610 0.81 CYP1A2 (0.41) FAAHCA1CA2LMNACYP1A2
SCHEMBL8166449 0.76 GPR84 (0.33)
SCHEMBL5344889 0.73 CA1 (0.35) FAAHCA1CA2LMNACYP1A2
SCHEMBL6745345 0.73 CA1 (0.36) CA1CA2GABRA1HPGDGABRG2
SCHEMBL2783384 0.71 CA1 (0.32) CA1CA2
SCHEMBL319418 0.71 CYP2A6 (0.35) CA1CA2CYP1A2HPGDTSHR
SCHEMBL8766117 0.71 CA1 (0.32) CA1CA2
SCHEMBL30183336 0.71 CA1 (0.32) CA1CA2

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
EP-1250342-B1 BRIDGED METALLOCENE COMPOUNDS AS OLEFIN-POLYMERIZATION CATALYSTS POLIMERI EUROPA SPA (IT) 2006-06-28 EP disclosed
US-6984703-B1 Bridged metallocene compounds as olefin-polymerization catalysts POLIMERI EUROPA S.P.A. (IT) 2006-01-10 US disclosed