SCHEMBL11299453

SCHEMBL11299453

CCCCc1cc(C)ccc1N(CC)CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.37
TLR7 Q9NYK1 1/20 0.37
MAPT P10636 4/20 0.36
HTT P42858 3/20 0.36
ALDH1A1 P00352 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
GAA P10253 1/20 0.36
THRB P10828 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
POLB P06746 2/20 0.34
TP53 P04637 2/20 0.34
NPC1 O15118 2/20 0.34
MAPK1 P28482 2/20 0.34
RAB9A P51151 2/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A3 P47895 1/20 0.33
SKP2 Q13309 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
Hydrochloric Acid SCHEMBL11423810 0.98 MAPT (0.38) TYRTLR7MAPTHTTALDH1A1
SCHEMBL11329224 0.93 TYR (0.40) TYRMAPTHTTALDH1A1NPSR1
Hydrochloric Acid SCHEMBL11407286 0.92 MAPT (0.40) TYRMAPTHTTALDH1A1NPSR1
SCHEMBL27908273 0.84 TYR (0.38) TYRTLR7MAPTHTTALDH1A1
SCHEMBL11723760 0.78 ALDH1A3 (0.35) MAPTHTTALDH1A1NPSR1GAA
SCHEMBL28094009 0.77 TYR (0.48) TYRTLR7MAPTHTTALDH1A1
SCHEMBL11725286 0.76 ALDH1A3 (0.34) MAPTHTTALDH1A1GAATAAR1
SCHEMBL10348400 0.76 LIPG (0.43) TYRTLR8KCNH2CYP3A4ALOX5
SCHEMBL630179 0.75 TAAR1 (0.61) TYRTLR7MAPTHTTALDH1A1
SCHEMBL28416322 0.73 TYR (0.46) TYRTLR7MAPTHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4254092-A Method for separating hydrogen chloride and hydrogen bromide CHEMISCHE WERKE HULS AG (DE) 1981-03-03 US claimed
EP-0027508-B1 PROCESS FOR PREPARING AMMONIA AND HYDROGEN CHLORIDE FROM AMMONIUM CHLORIDE CHEMISCHE WERKE HÜLS AG (DE) 1982-07-28 EP disclosed
US-4305917-A AMINO HYDROCHLORIDE FORMATION CHEMISCHE WERKE HULS AG (DE) 1981-12-15 US disclosed
EP-0003472-B1 PROCESS FOR SEPARATING HYDROGEN CHLORIDE FROM SOLUTIONS OF AMINO-HYDROCHLORIDES CHEMISCHE WERKE HÜLS AG (DE) 1981-09-16 EP disclosed
EP-0008330-B1 PROCESS FOR THE SEPARATION OF HYDROGEN CHLORIDE AND HYDROGEN BROMINE CHEMISCHE WERKE HÜLS AG (DE) 1981-05-20 EP disclosed
EP-0027508-A1 Process for preparing ammonia and hydrogen chloride from ammonium chloride CHEMISCHE WERKE HÜLS AG (DE) 1981-04-29 EP disclosed
US-4254092-A Method for separating hydrogen chloride and hydrogen bromide CHEMISCHE WERKE HULS AG (DE) 1981-03-03 US disclosed
EP-0003472-A2 Process for separating hydrogen chloride from solutions of amino-hydrochlorides CHEMISCHE WERKE HÜLS AG (DE) 1979-08-22 EP disclosed
US-4115530-A EXTRACTION WITH AMINES CHEMISCHE WERKE HULS AG (DE) 1978-09-19 US disclosed