SCHEMBL4267372

SCHEMBL4267372

CCCCC(CCCC)O[Sn].CCCCCOC(=O)OCCCCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.44
PLA2G2C Q5R387 1/20 0.44
HCAR2 Q8TDS4 2/20 0.43
EPHX1 P07099 1/20 0.42
TSHR P16473 4/20 0.41
ALDH1A1 P00352 2/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 1/20 0.39
RAD52 P43351 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ESR1 P03372 1/20 0.38
AKR1C4 P17516 1/20 0.38
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38
AKR1C1 Q04828 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
FAAH O00519 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL4272114 0.97 NAAA (0.46) NAAAPLA2G2CHCAR2EPHX1TSHR
SCHEMBL4267332 0.97 NAAA (0.46) NAAAPLA2G2CHCAR2EPHX1TSHR
SCHEMBL4267978 0.97 NAAA (0.46) NAAAPLA2G2CHCAR2EPHX1TSHR
SCHEMBL4277386 0.95 NAAA (0.47) NAAAPLA2G2CHCAR2EPHX1TSHR
SCHEMBL4278007 0.95 NAAA (0.47) NAAAPLA2G2CHCAR2EPHX1TSHR
SCHEMBL4266390 0.91 ALDH1A1 (0.42) NAAAPLA2G2CHCAR2EPHX1TSHR
SCHEMBL4273780 0.88 NAAA (0.41) NAAAPLA2G2CHCAR2EPHX1TSHR
SCHEMBL4270184 0.84 CA2 (0.41) PLA2G2CHCAR2TSHRALDH1A1CYP3A4
SCHEMBL4272119 0.81 ZDHHC7 (0.40) NAAAPLA2G2CHCAR2EPHX1CA1
SCHEMBL37366 0.80 NAAA (0.62) NAAAHCAR2EPHX1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362289-B2 Mixture for recovery utilization or transfer of carbon dioxide ASAHI KASEI CHEMICALS CORPORATION (JP) 2013-01-29 US disclosed
EP-2006013-B1 MIXTURE FOR CARBON DIOXIDE RECOVERY/UTILIZATION AND TRANSPORTATION ASAHI KASEI CHEMICALS CORP (JP) 2013-01-02 EP disclosed
EP-2006013-A9 MIXTURE FOR CARBON DIOXIDE RECOVERY/UTILIZATION AND TRANSPORTATION Asahi Kasei Chemicals Corporation (JP) 2009-07-22 EP disclosed
US-20090169461-A1 Mixture For Recovery Utilization Or Transfer Of Carbon Dioxide ASAHI KASEI KABUSHIKI KAISHA (JP) 2009-07-02 US disclosed
EP-2006013-A2 MIXTURE FOR CARBON DIOXIDE RECOVERY/UTILIZATION AND TRANSPORTATION Asahi Kasei Chemicals Corporation (JP) 2008-12-24 EP disclosed