SCHEMBL8675347

SCHEMBL8675347

CCCCC(C(=O)OBr)(c1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 3/20 0.49
SCN2A Q99250 3/20 0.49
SCN3A Q9NY46 3/20 0.49
LMNA P02545 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2D6 P10635 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
TSHR P16473 1/20 0.49
NFKB1 P19838 1/20 0.49
MTOR P42345 1/20 0.49
RAB9A P51151 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
KDM4E B2RXH2 1/20 0.48
NR1I2 O75469 1/20 0.48
CYP1A1 P04798 1/20 0.48
CYP2E1 P05181 1/20 0.48

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
SCHEMBL13963989 0.85 KCNN4 (0.53) SCN1ASCN2ASCN3ALMNACYP1A2
SCHEMBL28047418 0.84 SCN1A (0.56) SCN1ASCN2ASCN3ALMNACYP1A2
SCHEMBL8675338 0.83 CHRM2 (0.56) SCN1ASCN2ASCN3ALMNACYP1A2
SCHEMBL28319844 0.83 CYP3A4 (0.62) SCN1ASCN2ASCN3ALMNACYP1A2
SCHEMBL28335137 0.81 CYP3A4 (0.60) SCN1ASCN2ASCN3ALMNACYP1A2
SCHEMBL27572321 0.81 OPRM1 (0.49) SCN1ASCN2ASCN3ALMNACYP1A2
Bromide SCHEMBL9938236 0.80 SCN1A (0.46) SCN1ASCN2ASCN3ALMNACYP1A2
SCHEMBL7056880 0.79 SCN1A (0.48) SCN1ASCN2ASCN3ALMNACYP1A2
SCHEMBL7057728 0.79 SCN1A (0.48) SCN1ASCN2ASCN3ALMNACYP1A2
SCHEMBL27725790 0.79 SCN1A (0.51) SCN1ASCN2ASCN3ALMNACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5728911-A CATALYTIC SOLUTION COPOLYMERIZATION OF ETHYLENE WITH POLYUNSATURATED MONOMER DSM COPOLYMER, INC. (US) 1998-03-17 US disclosed
EP-0705284-B1 PROCESS FOR THE PREPARATION OF LOW MOLECULAR WEIGHT COPOLYMERS OF ETHYLENE WITH AT LEAST ONE OTHER 1-ALKENE DSM NV (NL) 1997-07-09 EP disclosed
EP-0705284-A1 PROCESS FOR THE PREPARATION OF LOW MOLECULAR WEIGHT COPOLYMERS OF ETHYLENE WITH AT LEAST ONE OTHER 1-ALKENE DSM NV (NL) 1996-04-10 EP disclosed
WO-1995000564-A1 PROCESS FOR THE PREPARATION OF LOW MOLECULAR WEIGHT COPOLYMERS OF ETHYLENE WITH AT LEAST ONE OTHER 1-ALKENE DSM N.V. (NL) 1995-01-05 WO disclosed
EP-0044119-B1 PROCESS FOR THE PREPARATION OF COPOLYMERS OF ETHYLENE WITH AT LEAST ONE OTHER 1-ALKENE STAMICARBON B.V. (NL) 1985-05-29 EP disclosed
US-4435552-A COORDINATION CATALYST CONTAINING HALOACYL COMPOUND STAMICARBON B.V. (NL) 1984-03-06 US disclosed
EP-0044119-A2 Process for the preparation of copolymers of ethylene with at least one other 1-alkene STAMICARBON B.V. (NL) 1982-01-20 EP disclosed