SCHEMBL9813845

SCHEMBL9813845

CC1CC(C)(C)NC(C)(C)C1.CCCCCCCCCCCCCCCCCCOC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.40
EPHX1 P07099 1/20 0.38
TSHR P16473 3/20 0.37
HTR2C P28335 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
EPHX2 P34913 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
RAD52 P43351 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 2/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
FAAH O00519 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL9813582 0.94 CHRM2 (0.34) NAAATSHRLMNA
SCHEMBL10957842 0.78 NAAA (0.43) NAAAEPHX1TSHREPHX2HCAR2
SCHEMBL11444732 0.78 NAAA (0.43) NAAAEPHX1TSHREPHX2HCAR2
SCHEMBL473289 0.78 NAAA (0.61) NAAAEPHX1TSHRHTR2CPRSS1
SCHEMBL104550 0.78 NAAA (0.61) NAAAEPHX1TSHRHTR2CPRSS1
SCHEMBL1416698 0.78 NAAA (0.61) NAAAEPHX1TSHRHTR2CPRSS1
SCHEMBL1837930 0.78 NAAA (0.61) NAAAEPHX1TSHRHTR2CPRSS1
SCHEMBL35190 0.78 NAAA (0.61) NAAAEPHX1TSHRHTR2CPRSS1
SCHEMBL76043 0.78 NAAA (0.61) NAAAEPHX1TSHRHTR2CPRSS1
SCHEMBL473104 0.78 NAAA (0.61) NAAAEPHX1TSHRHTR2CPRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0163245-B1 DERIVATIVES OF ALKYL-SUBSTITUTED 4-HYDROXY-METHYL-PIPERIDINE AND USE THEREOF AS STABILIZERS AUSIMONT S.r.l. (IT) 1991-07-31 EP disclosed
US-4772708-A STABILIZERS FOR POLYMERS AUSIMONT S.P.A. (IT) 1988-09-20 US disclosed
EP-0163245-A2 Derivatives of alkyl-substituted 4-hydroxy-methyl-piperidine and use thereof as stabilizers AUSIMONT S.r.l. (IT) 1985-12-04 EP disclosed