SCHEMBL2875692

SCHEMBL2875692

BrC(Br)CCCc1ccc(CCCC(Br)Br)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 2/20 0.37
HTR2A P28223 3/20 0.36
MAOB P27338 2/20 0.36
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
ESR1 P03372 2/20 0.33
ADRA2A P08913 2/20 0.33
ADORA3 P0DMS8 2/20 0.33
TACR2 P21452 2/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 2/20 0.33
GFER P55789 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
SHBG P04278 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
HSPD1 P10809 1/20 0.33

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
SCHEMBL2876020 0.92 MAOB (0.39) HTR2AMAOBESR1ADRA2AADORA3
SCHEMBL4619735 0.89 ESR1 (0.54) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL6686320 0.80 MAOA (0.52) MAOB
SCHEMBL6686632 0.79 SIGMAR1 (0.52) MAOB
SCHEMBL6685308 0.79 SIGMAR1 (0.52) MAOB
SCHEMBL2875697 0.74 TAAR1 (0.33) FDFT1HTR2ASLC6A2SLC6A4SLC6A3
SCHEMBL4618538 0.72 ESR1 (0.59) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL4192867 0.70 TDP1 (0.52) HTR2AMAOBALDH1A1HSD17B10TAAR1
SCHEMBL1487691 0.69 MAOB (0.48) MAOB
SCHEMBL178077 0.69 ALDH1A1 (0.46) HTR2AMAOBSLC6A3ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100151392-A1 ANTIREFLECTIVE COATING COMPOSITIONS RAHMAN M DALIL 2010-06-17 US disclosed