SCHEMBL18459626

SCHEMBL18459626

O=C(NCCCCCCNC(=O)C(=O)NCCc1ccccc1)C(=O)NCCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLAAT5 Q96KN8 8/20 0.67
▸ PLAAT4 Q9UL19 8/20 0.67
▸ PLAAT3 P53816 7/20 0.67
▸ PLAAT2 Q9NWW9 7/20 0.67
▸ TRPV1 Q8NER1 1/20 0.62
▸ SMN1; SMN2 Q16637 3/20 0.61
▸ CA12 O43570 1/20 0.59
▸ CA2 P00918 1/20 0.59
▸ CA9 Q16790 1/20 0.59
▸ NPC1 O15118 3/20 0.58
▸ RAB9A P51151 3/20 0.58
▸ HDAC3 O15379 1/20 0.58
▸ HDAC1 Q13547 1/20 0.58
▸ HDAC2 Q92769 1/20 0.58
▸ HDAC10 Q969S8 1/20 0.58
▸ HDAC11 Q96DB2 1/20 0.58
▸ HDAC8 Q9BY41 1/20 0.58
▸ HDAC6 Q9UBN7 1/20 0.58
▸ NCOR2 Q9Y618 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58

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
SCHEMBL22412530 0.92 PLAAT5 (0.75) PLAAT5PLAAT4PLAAT3PLAAT2SMN1; SMN2
SCHEMBL20673342 0.85 SMN1; SMN2 (0.81) PLAAT5PLAAT4PLAAT3PLAAT2SMN1; SMN2
SCHEMBL18459797 0.85 L3MBTL1 (0.65) TRPV1SMN1; SMN2L3MBTL1EPHX1ALDH1A1
SCHEMBL4831685 0.84 PLAAT5 (0.70) PLAAT5PLAAT4PLAAT3PLAAT2SMN1; SMN2
SCHEMBL6175376 0.83 CYP1A2 (0.70) PLAAT5PLAAT4PLAAT3PLAAT2SMN1; SMN2
SCHEMBL9867729 0.83 PLAAT5 (0.64) PLAAT5PLAAT4PLAAT3PLAAT2SMN1; SMN2
SCHEMBL18460166 0.82 L3MBTL1 (0.67) SMN1; SMN2L3MBTL1EPHX1ALDH1A1MEN1
SCHEMBL3413251 0.81 KMT2A (0.71) PLAAT5PLAAT4PLAAT3PLAAT2SMN1; SMN2
SCHEMBL8507635 0.81 HPGD (0.68) NPC1RAB9AEPHX1ALDH1A1MEN1
SCHEMBL15750230 0.81 PRMT1 (0.65) PLAAT5PLAAT4PLAAT3PLAAT2SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10844305-B2 Process for preparing a grease SHELL OIL COMPANY (US) 2020-11-24 — — US disclosed
US-20180223212-A1 PROCESS FOR PREPARING A GREASE SHELL USA, INC. 2018-08-09 — — US disclosed
US-20180223212-A1 PROCESS FOR PREPARING A GREASE SHELL USA, INC. 2018-08-09 — — US disclosed
WO-2017017020-A1 PROCESS FOR PREPARING A GREASE SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2017-02-02 — — WO disclosed
Send feedback