SCHEMBL9637513

SCHEMBL9637513

CCCCC(CCCC)CO[PH](=O)OCC(CCCC)CCCC

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TSHR P16473 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 5/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
CA2 P00918 5/20 0.35
CA1 P00915 2/20 0.33
LMNA P02545 1/20 0.33
RECQL P46063 1/20 0.33
CA12 O43570 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
FDPS P14324 1/20 0.32
DNM1 Q05193 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
SCHEMBL8434992 0.96 CYP3A4 (0.41) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL28532180 0.94 LMNA (0.43) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL329554 0.91 CYP3A4 (0.55) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL28822364 0.90 CYP3A4 (0.53) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL30249980 0.90 CYP3A4 (0.53) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL28689341 0.90 CYP3A4 (0.53) CYP3A4L3MBTL1TSHRTDP1ATM
Hexane SCHEMBL28501779 0.90 CYP3A4 (0.53) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL31416102 0.90 CYP3A4 (0.53) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL30250357 0.90 CYP3A4 (0.53) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL26983493 0.90 LMNA (0.39) CYP3A4L3MBTL1TSHRTDP1ATM

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-0340975-B1 ETHYLENE COPOLYMERS AS SORBERS OF METALLIC IONS FROM SOLUTIONS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-09-30 EP disclosed
US-5115036-A Ethylene-aminoalkyl (meth)acrylate copolymer; waste water treatment SUMITOMO CHEMICAL CO., LTD. (JP) 1992-05-19 US disclosed
US-5064879-A METHOD FOR SORBING METALLIC IONS USING ETHYLENE-N,N-DIALKYL AMINOALKYL ACRYLATES POLYMERS SUMITOMO CHEMICAL CO., LTD. (JP) 1991-11-12 US disclosed
EP-0340975-A1 Ethylene copolymers as sorbers of metallic ions from solutions SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-11-08 EP disclosed