SCHEMBL8533207

SCHEMBL8533207

C=CCc1cccc(C(Cl)Cl)c1CC=C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.43
GABRB2 P47870 2/20 0.43
AKR1B1 P15121 1/20 0.34
ADRA2C P18825 3/20 0.34
ADRA2A P08913 2/20 0.34
ADRA2B P18089 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
GAA P10253 1/20 0.31
XDH P47989 1/20 0.30
ADRB2 P07550 2/20 0.30
ADRB1 P08588 2/20 0.30
HTR1A P08908 1/20 0.30
ADRB3 P13945 1/20 0.30
SLC6A2 P23975 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
SCHEMBL18136 0.80 GABRA1 (0.56) GABRA1GABRB2AKR1B1ADRA2CADRA2A
SCHEMBL2469944 0.75 GABRA1 (0.47) GABRA1GABRB2AKR1B1ADRA2CADRA2A
SCHEMBL968136 0.75 GABRA1 (0.47) GABRA1GABRB2AKR1B1ADRA2CADRA2B
SCHEMBL28398132 0.74 GABRA1 (0.50) GABRA1GABRB2AKR1B1ADRA2CADRA2A
SCHEMBL4170461 0.74 GABRA1 (0.50) GABRA1GABRB2AKR1B1ADRA2CADRA2A
SCHEMBL2362269 0.74 GABRA1 (0.61) GABRA1GABRB2AKR1B1ADRA2CADRA2A
SCHEMBL9571743 0.74 GABRA1 (0.40) GABRA1GABRB2AKR1B1ADRA2CMEN1
SCHEMBL5683696 0.74 PTGS2 (0.46) GABRA1GABRB2ADRA2CADRA2AADRA2B
SCHEMBL12076599 0.73 GABRA1 (0.54) GABRA1GABRB2AKR1B1ADRA2CADRA2A
Ammonia Solution, Strong SCHEMBL19307331 0.73 GABRA1 (0.46) GABRA1GABRB2AKR1B1ADRA2CADRA2A

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-0714556-B1 LIGHT-EMITTING DIODE COMPRISING AN ACTIVE LAYER OF 2,5-SUBSTITUTED POLY(P-PHENYLENE VINYLENE) KONINKL PHILIPS ELECTRONICS NV (NL) 1999-01-20 EP disclosed
EP-0714556-A1 LIGHT-EMITTING DIODE COMPRISING AN ACTIVE LAYER OF 2,5-SUBSTITUTED POLY(P-PHENYLENE VINYLENE) Koninklijke Philips Electronics N.V. (NL) 1996-06-05 EP disclosed
WO-1995032526-A1 LIGHT-EMITTING DIODE COMPRISING AN ACTIVE LAYER OF 2,5-SUBSTITUTED POLY(P-PHENYLENE VINYLENE) PHILIPS ELECTRONICS N.V. (NL) 1995-11-30 WO disclosed