SCHEMBL11288889

SCHEMBL11288889

Cc1cccc(C)c1C/C=C/c1ncc[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 7/20 0.51
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
HTR1A P08908 2/20 0.36
ACP1 P24666 1/20 0.35
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTR1D P28221 1/20 0.33
F2RL1 P55085 1/20 0.33
TLK2 Q86UE8 1/20 0.32
ALOX5 P09917 1/20 0.32
ADRA2A P08913 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
PARP1 P09874 1/20 0.31
NISCH Q9Y2I1 1/20 0.31
AR P10275 1/20 0.31
ADRA1D P25100 1/20 0.30
ADRA1A P35348 1/20 0.30
ADRA1B P35368 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
SCHEMBL11288890 1.00 TAAR1 (0.51) TAAR1NPC1RAB9AHTR1AACP1
SCHEMBL11292830 0.85 TAAR1 (0.49) TAAR1NPC1RAB9AHTR1AALDH1A1
SCHEMBL11292832 0.85 TAAR1 (0.49) TAAR1NPC1RAB9AHTR1AALDH1A1
SCHEMBL11298150 0.84 TAAR1 (0.41) TAAR1NPC1RAB9AHTR1AALDH1A1
SCHEMBL11293787 0.84 TAAR1 (0.48) TAAR1NPC1RAB9AHTR1AALDH1A1
SCHEMBL11293809 0.82 TAAR1 (0.47) TAAR1NPC1RAB9AHTR1AALDH1A1
SCHEMBL11294169 0.81 TAAR1 (0.51) TAAR1NPC1RAB9AHTR1AACP1
SCHEMBL11294167 0.81 TAAR1 (0.51) TAAR1NPC1RAB9AHTR1AACP1
SCHEMBL11299731 0.77 TAAR1 (0.45) TAAR1NPC1RAB9AHTR1AALDH1A1
SCHEMBL11299729 0.77 TAAR1 (0.45) TAAR1NPC1RAB9AHTR1AALDH1A1

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
EP-0064820-A1 Substituted imidazole and imidazoline derivatives and their preparation and use Farmos-Yhtyma Oy (FI) 1982-11-17 EP disclosed