SCHEMBL18568293

SCHEMBL18568293

CCCN(CCc1ccccc1Cl)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.53
AOC3 Q16853 1/20 0.50
CYP51A1 Q16850 1/20 0.45
TP53 P04637 1/20 0.45
CTBP2 P56545 1/20 0.43
HTT P42858 1/20 0.42
EGFR P00533 1/20 0.41
HTR3E A5X5Y0 1/20 0.41
HTR3B O95264 1/20 0.41
HTR3A P46098 1/20 0.41
HTR3D Q70Z44 1/20 0.41
HTR3C Q8WXA8 1/20 0.41
HTR1A P08908 1/20 0.41
HIF1A Q16665 1/20 0.41
PLAAT3 P53816 1/20 0.41
PLAAT5 Q96KN8 1/20 0.41
PLAAT2 Q9NWW9 1/20 0.41
PLAAT4 Q9UL19 1/20 0.41

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
SCHEMBL18567626 0.83 TAAR1 (0.50) TAAR1AOC3HTTEGFRHTR3E
SCHEMBL5502998 0.79 TAAR1 (0.44) TAAR1AOC3CYP51A1TP53HTT
SCHEMBL1179682 0.79 TAAR1 (0.46) TAAR1AOC3CTBP2HTR3EHTR3B
SCHEMBL18422574 0.79 TAAR1 (0.62) TAAR1AOC3CTBP2HTR3EHTR3B
SCHEMBL15066241 0.79 CYP51A1 (0.44) TAAR1CYP51A1TP53CTBP2HTT
SCHEMBL19254215 0.79 CYP51A1 (0.44) TAAR1CYP51A1TP53CTBP2HTT
SCHEMBL28960395 0.77 TAAR1 (0.51) TAAR1AOC3CYP51A1HTR3EHTR3B
SCHEMBL4524834 0.76 TAAR1 (0.41) TAAR1AOC3HTR3EHTR3BHTR3A
SCHEMBL1181113 0.76 TAAR1 (0.41) TAAR1AOC3HTR3EHTR3BHTR3A
SCHEMBL4517362 0.76 TAAR1 (0.40) TAAR1AOC3CTBP2HTR3EHTR3B

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-2797880-B1 PHENYL CARBAMATE COMPOUNDS FOR USE IN PREVENTING OR TREATING EPILEPSY BIO-PHARM SOLUTIONS CO LTD (KR) 2017-03-01 EP disclosed