SCHEMBL4559147

SCHEMBL4559147

C=CCC1CCCC(CC=C)C1O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PRSS1 P07477 2/20 0.32
▸ CTRC Q99895 2/20 0.32
▸ F2 P00734 1/20 0.32
▸ NOS1 P29475 2/20 0.31
▸ NOS2 P35228 2/20 0.31
▸ NOS3 P29474 1/20 0.31
▸ CHRNB2 P17787 1/20 0.30
▸ CHRNB4 P30926 1/20 0.30
▸ CHRNA3 P32297 1/20 0.30
▸ CHRNA7 P36544 1/20 0.30
▸ CHRNA4 P43681 1/20 0.30

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
SCHEMBL6402678 0.90 MEN1 (0.36) MEN1ALDH1A1KMT2ACHRNB2CHRNB4
SCHEMBL1074008 0.83 — —
SCHEMBL178594 0.83 — —
SCHEMBL2895289 0.83 — —
SCHEMBL1259162 0.83 — —
SCHEMBL23670831 0.83 — —
SCHEMBL21122609 0.82 MEN1 (0.38) MEN1ALDH1A1KMT2APRSS1CTRC
SCHEMBL28755839 0.78 NOS1 (0.39) MEN1ALDH1A1KMT2APRSS1CTRC
SCHEMBL5831802 0.78 NOS1 (0.39) MEN1ALDH1A1KMT2APRSS1CTRC
SCHEMBL733247 0.78 CA1 (0.46) MEN1ALDH1A1KMT2ANOS1NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2805974-B1 EMULSIFYING AGENT FOR EMULSION POLYMERIZATION DAI ICHI KOGYO SEIYAKU CO LTD (JP) 2016-11-30 — — EP disclosed
EP-2805974-A1 EMULSIFYING AGENT FOR EMULSION POLYMERIZATION Dai-Ichi Kogyo Seiyaku Co., Ltd. (JP) 2014-11-26 — — EP disclosed
US-20090076306-A1 PROCESS FOR CONTINUOUS PREPARATION OF A PRIMARY AROMATIC AMINE BASF SE (DE) 2009-03-19 — — US disclosed
EP-0072988-B1 USE OF 1,3-DIALKYLCYCLOHEXANES AS COSMETICAL OIL COMPONENT Henkel Kommanditgesellschaft auf Aktien (DE) 1985-10-02 — — EP disclosed
US-4457944-A REFATTING OILS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1984-07-03 — — US disclosed
EP-0072988-A1 Use of 1,3-Dialkylcyclohexanes as cosmetical oil component Henkel Kommanditgesellschaft auf Aktien (DE) 1983-03-02 — — EP disclosed
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