SCHEMBL11297264

SCHEMBL11297264

CC(C)CCCCCCCCC(N)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.44
TAAR1 Q96RJ0 2/20 0.42
AOC3 Q16853 2/20 0.42
SCN4A P35499 3/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2C P18825 1/20 0.41
LMNA P02545 1/20 0.41
HIF1A Q16665 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41
MMP9 P14780 1/20 0.40

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
SCHEMBL27490670 0.98 TAAR1 (0.43) SLC2A1TAAR1AOC3SCN4AADRA2A
SCHEMBL11681727 0.94 TAAR1 (0.43) TAAR1AOC3SCN4AADRA2AADRA2C
SCHEMBL17373052 0.87 SCN4A (0.50) SLC2A1TAAR1SCN4AHTR2AHRH1
SCHEMBL13996063 0.85 TAAR1 (0.46) TAAR1AOC3SCN4AADRA2AADRA2C
SCHEMBL13619701 0.85 TAAR1 (0.46) TAAR1AOC3SCN4AADRA2AADRA2C
Hydrochloric Acid SCHEMBL28350804 0.85 SCN4A (0.48) SLC2A1TAAR1SCN4AHTR2AHRH1
SCHEMBL4080852 0.84 SLC2A1 (0.60) SLC2A1HTR2A
SCHEMBL10589876 0.84 SLC2A1 (0.60) SLC2A1HTR2A
SCHEMBL4071245 0.84 SLC2A1 (0.60) SLC2A1HTR2A
SCHEMBL8785774 0.84 SLC2A1 (0.60) SLC2A1HTR2A

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
US-4359418-A YELLOW, ORANGE COLOR CIBA-GEIGY CORPORATION (US) 1982-11-16 US disclosed
EP-0005222-A2 Salts of sulphonated azo dyes and their use CIBA-GEIGY AG (CH) 1979-11-14 EP disclosed