SCHEMBL9813699

SCHEMBL9813699

CC1CC(C)(C)NC(C)(C)C1.O=C(O)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.41
GAA P10253 2/20 0.39
TSHR P16473 3/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
GABRA4 P48169 1/20 0.36
GABRE P78334 1/20 0.36
PMP22 Q01453 1/20 0.36
GABRA6 Q16445 1/20 0.36
GABRG1 Q8N1C3 1/20 0.36
GABRG3 Q99928 1/20 0.36
GABRQ Q9UN88 1/20 0.36

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
Cyclohexane SCHEMBL9813599 0.81 GAA (0.38) APLNRGAATSHRLMNARECQL
Acetic Acid SCHEMBL9813575 0.78 GAA (0.41) APLNRGAATSHRRECQLPOLB
SCHEMBL83010 0.76 APLNR (0.61) APLNRGAATSHRGABRPGABRD
SCHEMBL31733905 0.76 CES2 (0.48) APLNRGAATSHRGABRPGABRD
SCHEMBL16062725 0.76 CES2 (0.48) APLNRGAATSHRGABRPGABRD
SCHEMBL9869409 0.76 GAA (0.41) APLNRGAATSHRHSD11B1LMNA
SCHEMBL223962 0.74 EPHX1 (0.47) GAATSHRGABRPGABRDGABRA1
SCHEMBL13457435 0.74 TSHR (0.44) APLNRGAATSHRGABRPGABRD
Cyclohexane SCHEMBL28236664 0.73 CES2 (0.55) APLNRGAATSHRGABRPGABRD
SCHEMBL327787 0.73 RECQL (0.38) GAATSHRLMNARECQLPOLB

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