SCHEMBL18928532

SCHEMBL18928532

CCOCCOCCOCCOc1cccc(CC)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.56
ALDH1A1 P00352 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
MAPK1 P28482 3/20 0.55
TSHR P16473 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
SOD1 P00441 1/20 0.50
HTT P42858 1/20 0.49
POLB P06746 1/20 0.47
GAA P10253 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
NCF1 P14598 1/20 0.44

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
SCHEMBL14731232 0.90 KDM4E (0.56) KDM4EALDH1A1SMN1; SMN2MAPK1TSHR
SCHEMBL15295402 0.89 ALDH1A1 (0.65) KDM4EALDH1A1SMN1; SMN2MAPK1TSHR
SCHEMBL25823215 0.89 KDM4E (0.56) KDM4EALDH1A1SMN1; SMN2MAPK1TSHR
SCHEMBL16667635 0.87 KDM4E (0.59) KDM4EALDH1A1MAPK1TSHRL3MBTL1
SCHEMBL16669059 0.87 KDM4E (0.59) KDM4EALDH1A1MAPK1TSHRL3MBTL1
SCHEMBL10799020 0.86 KDM4E (0.58) KDM4EALDH1A1SMN1; SMN2MAPK1TSHR
SCHEMBL15219217 0.85 KDM4E (0.57) KDM4EALDH1A1MAPK1TSHRL3MBTL1
SCHEMBL14724421 0.85 TSHR (0.48) KDM4EALDH1A1SMN1; SMN2MAPK1TSHR
SCHEMBL8057463 0.84 ALDH1A1 (0.59) KDM4EALDH1A1SMN1; SMN2MAPK1TSHR
SCHEMBL21569277 0.83 KDM4E (0.50) KDM4ESMN1; SMN2TSHRHTTLMNA

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
WO-2019217514-A1 ANTI-CORROSION MATERIAL-COATED DISCRETE GRAPHENE SHEETS AND ANTI-CORROSION COATING COMPOSITION CONTAINING SAME NANOTEK INSTRUMENTS, INC. (US) 2019-11-14 WO disclosed
WO-2019217402-A1 GRAPHENE-ENABLED ANTI-CORROSION COATING NANOTEK INSTRUMENTS, INC. (US) 2019-11-14 WO disclosed
WO-2019183044-A1 GRAPHENE-MEDIATED METALLIZATION OF POLYMER FILMS NANOTEK INSTRUMENTS, INC. (US) 2019-09-26 WO disclosed
WO-2019051143-A1 PRODUCTION OF GRAPHENE MATERIALS DIRECTLY FROM CARBON/GRAPHITE PRECURSOR NANOTEK INSTRUMENTS, INC. (US) 2019-03-14 WO disclosed
WO-2017095512-A1 CHEMICAL-FREE PRODUCTION OF GRAPHENE MATERIALS ANGSTRON MATERIALS, INC. (US) 2017-06-08 WO disclosed