SCHEMBL28063236

SCHEMBL28063236

CC(N)CC(N)C1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.41
SHBG P04278 1/20 0.41
DPP4 P27487 2/20 0.39
TP53 P04637 1/20 0.38
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
KDM4E B2RXH2 1/20 0.37
GMNN O75496 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
BLM P54132 1/20 0.37
PMP22 Q01453 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL15108137 0.87
SCHEMBL13995102 0.86 EPHX1 (0.41) EPHX1SHBGDPP4TP53ALDH1A1
SCHEMBL13995101 0.86 EPHX1 (0.41) EPHX1SHBGDPP4TP53ALDH1A1
SCHEMBL18849500 0.85 EPHX1 (0.48) EPHX1SHBGDPP4TP53ALDH1A1
SCHEMBL172567 0.83 ALDH1A1 (0.39) EPHX1SHBGDPP4TP53ALDH1A1
SCHEMBL13995117 0.83 ALDH1A1 (0.39) EPHX1SHBGDPP4TP53ALDH1A1
SCHEMBL7319672 0.81 TP53 (0.41) EPHX1SHBGDPP4TP53ALDH1A1
SCHEMBL7295223 0.81 TP53 (0.41) EPHX1SHBGDPP4TP53ALDH1A1
SCHEMBL9746111 0.81 TP53 (0.41) EPHX1SHBGDPP4TP53ALDH1A1
SCHEMBL7304692 0.81 TP53 (0.41) EPHX1SHBGDPP4TP53ALDH1A1

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
CN-106536589-A High heat monomer and method of use thereof 沙特基础工业全球技术有限公司 2017-03-22 CN claimed
CN-109847585-A The preparation method of composite nanometer filtering film and composite nanometer filtering film prepared therefrom 时代沃顿科技有限公司 2019-06-07 CN disclosed
CN-109153653-A New compound, Photocurable composition, its solidfied material, printing ink and the printed article for having used the printing ink DIC株式会社 2019-01-04 CN disclosed
CN-103827174-B Thermoplastic (co) polyimide and its synthesis 罗地亚经营管理公司 2016-08-24 CN disclosed
CN-105899361-A Gas barrier film and electronic device comprising same 柯尼卡美能达株式会社 2016-08-24 CN disclosed