SCHEMBL3396858

SCHEMBL3396858

CCC(C(N)O)C(C)Oc1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 1/20 0.36
NLRP1 Q9C000 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SCN5A Q14524 1/20 0.35
SCN2A Q99250 1/20 0.35
WDR5 P61964 1/20 0.35
MEN1 O00255 1/20 0.35
PPARG P37231 2/20 0.33
PPARA Q07869 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
USP2 O75604 1/20 0.33
TSHR P16473 1/20 0.33
TRPM8 Q7Z2W7 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
SCHEMBL3400184 0.80 MAPT (0.36) MAPTKMT2AALDH1A1NLRP1NPSR1
SCHEMBL3399534 0.79 KMT2A (0.38) MAPTKMT2AALDH1A1NLRP1SCN5A
SCHEMBL3402150 0.75 SCN4A (0.46) SCN5ASCN2ALMNATSHR
SCHEMBL3400708 0.75 WDR5 (0.39) MAPTKMT2AALDH1A1NLRP1SCN5A
Hydrochloric Acid SCHEMBL3402328 0.74 SCN5A (0.46) SCN5ASCN2ALMNATSHR
SCHEMBL19493387 0.74 ACHE (0.42) MAPTKMT2AALDH1A1NLRP1SCN5A
SCHEMBL8723823 0.74 ACHE (0.42) MAPTKMT2AALDH1A1NLRP1NPSR1
SCHEMBL5960247 0.74 ACHE (0.42) MAPTKMT2AALDH1A1NLRP1WDR5
SCHEMBL17904768 0.74 ACHE (0.42) MAPTKMT2AALDH1A1NLRP1NPSR1
SCHEMBL10359315 0.72 ACHE (0.41) MAPTKMT2AALDH1A1NLRP1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101932551-A Aminoalkanol derivatives, process for producing aminoalkanols and use thereof UNIV JAGIELLONSKI 2010-12-29 CN claimed
EP-2247571-A2 DERIVATIVES OF AMINOALKANOLS, METHOD OF OBTAINING OF AMINOALKANOLS AND THEIR USE Uniwersytet Jagiellonski (PL) 2010-11-10 EP claimed
WO-2009093916-A2 DERIVATIVES OF AMINOALKANOLS, METHOD OF OBTAINING AMINOALKANOLS AND THEIR USE UNIWERSYTET JAGIELLONSKI (PL) 2009-07-30 WO claimed
CN-101932551-A Aminoalkanol derivatives, process for producing aminoalkanols and use thereof UNIV JAGIELLONSKI 2010-12-29 CN disclosed