SCHEMBL16415641

SCHEMBL16415641

CC(C)CNC(C)COCCOCCOCC(C)NCC(C)C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 2/20 0.34
ADRB1 P08588 2/20 0.34
POLB P06746 1/20 0.33
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL9559462 0.85 TSHR (0.36) POLBHSD17B10
SCHEMBL24819144 0.80 ALDH1A1 (0.39) ADH1BADH1CADH1A
SCHEMBL18327486 0.80 ALDH1A1 (0.39) ADH1BADH1CADH1A
SCHEMBL18327484 0.80 ALDH1A1 (0.39) ADH1BADH1CADH1A
SCHEMBL4396885 0.80 ADH1B (0.30) ADH1BADH1CADH1A
SCHEMBL5933527 0.80
SCHEMBL5932103 0.80
SCHEMBL5932423 0.78 SPHK1 (0.30)
SCHEMBL16415633 0.74 SIGMAR1 (0.38) ADRB2ADRB1HSD17B10
SCHEMBL17914312 0.72 HSD17B10 (0.33) ADRB2ADRB1HSD17B10

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
EP-3027293-A1 SEPARATION OF HYDROGEN SULFIDE FROM NATURAL GAS ExxonMobil Research and Engineering Company (US) 2016-06-08 EP disclosed
WO-2015017240-A1 SEPARATION OF HYDROGEN SULFIDE FROM NATURAL GAS EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2015-02-05 WO disclosed
US-20150027055-A1 SEPARATION OF HYDROGEN SULFIDE FROM NATURAL GAS EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2015-01-29 US disclosed
US-20150027056-A1 SEPARATION OF HYDROGEN SULFIDE FROM NATURAL GAS EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2015-01-29 US disclosed