SCHEMBL16701182

SCHEMBL16701182

CCCCCC[N+]1(OC(C)=O)CCCC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
CES2 O00748 4/20 0.39
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 1/20 0.35
NAAA Q02083 3/20 0.34
FAAH O00519 1/20 0.34
CES1 P23141 3/20 0.33
TSHR P16473 3/20 0.33
DGKA P23743 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
SLC22A8 Q8TCC7 1/20 0.32
GPR84 Q9NQS5 1/20 0.32

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
SCHEMBL15820573 0.98 LMNA (0.39) LMNAAPOBEC3AAPOBEC3GCES2ALDH1A1
SCHEMBL16700361 0.93 ALDH1A1 (0.38) LMNAAPOBEC3AAPOBEC3GCES2ALDH1A1
SCHEMBL15820187 0.85 LMNA (0.35) LMNAAPOBEC3AAPOBEC3GALDH1A1
SCHEMBL5801688 0.85 CDC25A (0.40) LMNAAPOBEC3AAPOBEC3GCES2
SCHEMBL10551152 0.83 LMNA (0.38) LMNAAPOBEC3AAPOBEC3GALDH1A1KMT2A
SCHEMBL1695937 0.83 LMNA (0.46) LMNACES2ALDH1A1KMT2ANAAA
SCHEMBL16569932 0.81 LMNA (0.37) LMNAAPOBEC3AAPOBEC3GCES2KMT2A
SCHEMBL16700592 0.80 FAAH (0.40) CES2KMT2AFAAHCES1
SCHEMBL15209391 0.76 ALDH1A1 (0.33) CES2ALDH1A1KMT2A
SCHEMBL16701138 0.72 FAAH (0.35) CES2KMT2AFAAHCES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3244987-B1 SEPARATIONS WITH IONIC LIQUID SOLVENTS CHEVRON PHILLIPS CHEMICAL CO LP (US) 2022-06-22 EP claimed
EP-3244987-A1 SEPARATIONS WITH IONIC LIQUID SOLVENTS Chevron Phillips Chemical Company LP (US) 2017-11-22 EP claimed
US-20150133711-A1 Separations With Ionic Liquid Solvents CHEVRON PHILLIPS CHEMICAL COMPANY LP 2015-05-14 US claimed
EP-3244987-B1 SEPARATIONS WITH IONIC LIQUID SOLVENTS CHEVRON PHILLIPS CHEMICAL CO LP (US) 2022-06-22 EP disclosed
US-10227274-B2 Separations with ionic liquid solvents CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2019-03-12 US disclosed
EP-3244987-A1 SEPARATIONS WITH IONIC LIQUID SOLVENTS Chevron Phillips Chemical Company LP (US) 2017-11-22 EP disclosed
US-20150133711-A1 Separations With Ionic Liquid Solvents CHEVRON PHILLIPS CHEMICAL COMPANY LP 2015-05-14 US disclosed