SCHEMBL6896465

SCHEMBL6896465

O=C(N1CCCCC1)C1(c2ccccc2)CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 1.00
KMT2A Q03164 1/20 1.00
HSD11B1 P28845 9/20 0.90
ALDH1A1 P00352 2/20 0.77
SMN1; SMN2 Q16637 1/20 0.77
LMNA P02545 1/20 0.77
TSHR P16473 1/20 0.77
NPSR1 Q6W5P4 1/20 0.77
HDAC4 P56524 2/20 0.60
AKR1C1 Q04828 1/20 0.59
MAPK1 P28482 1/20 0.52
SLC6A2 P23975 2/20 0.51
SLC6A4 P31645 2/20 0.51
SLC6A3 Q01959 1/20 0.51
CNR1 P21554 1/20 0.51
CNR2 P34972 1/20 0.51
GPR55 Q9Y2T6 1/20 0.51

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
SCHEMBL16507207 0.97 MEN1 (0.93) MEN1KMT2AHSD11B1ALDH1A1SMN1; SMN2
SCHEMBL3129900 0.93 HSD11B1 (1.00) MEN1KMT2AHSD11B1ALDH1A1SMN1; SMN2
SCHEMBL2479508 0.87 HSD11B1 (0.79) MEN1KMT2AHSD11B1ALDH1A1SMN1; SMN2
SCHEMBL18390061 0.87 MEN1 (0.77) MEN1KMT2AHSD11B1ALDH1A1SMN1; SMN2
SCHEMBL21733046 0.87 MEN1 (0.77) MEN1KMT2AHSD11B1ALDH1A1SMN1; SMN2
SCHEMBL8331178 0.87 HSD11B1 (0.79) MEN1KMT2AHSD11B1ALDH1A1SMN1; SMN2
SCHEMBL6543280 0.87 HSD11B1 (0.79) MEN1KMT2AHSD11B1ALDH1A1SMN1; SMN2
SCHEMBL11085490 0.87 MEN1 (0.77) MEN1KMT2AHSD11B1ALDH1A1SMN1; SMN2
SCHEMBL2858838 0.86 MEN1 (0.75) MEN1KMT2AHSD11B1ALDH1A1SMN1; SMN2
SCHEMBL8919562 0.85 HSD11B1 (0.79) MEN1KMT2AHSD11B1ALDH1A1SMN1; SMN2

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
EP-1409402-A2 ZEOLITE SSZ-59 Chevron USA, Inc. (US) 2004-04-21 EP disclosed
US-6632417-B2 Pyrrolidinium and quaternary ammonium alkylbenzene cations as structure directing agents CHEVRON U.S.A. INC. 2003-10-14 US disclosed
US-6547958-B1 Zeolite hydrocracking catalyst CHEVRON U.S.A. INC. 2003-04-15 US disclosed
US-20030066784-A1 Hydrocarbon conversion using zeolite SSZ-59 CHEVRON U.S.A. INC. 2003-04-10 US disclosed
WO-2003006363-A2 A PROCESS FOR PREPARING ZEOLITES CHEVRON U.S.A. INC. (US) 2003-01-23 WO disclosed
WO-2003006364-A2 ZEOLITE SSZ-59 CHEVRON U.S.A. INC. (US) 2003-01-23 WO disclosed
US-6464956-B1 N-METHYL-N-((1-PHENYLCYCLOPENTYL)METHYL) HEPTA(HEXA-, OR PENTA-)METHYLENEIMINIUM CATION TEMPLATE; HYDROCRACKING CATALYST CHEVRON U.S.A. INC. 2002-10-15 US disclosed
US-6461578-B1 Using zeolite SSZ-59 for reduction of oxides of nitrogen in a gas stream CHEVRON U.S.A. INC. 2002-10-08 US disclosed
US-20020085976-A1 Process for preparing zeolites CHEVRON U.S.A. INC. 2002-07-04 US disclosed