SCHEMBL3664930

SCHEMBL3664930

NC(CC1CO1)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.38
DPP4 P27487 1/20 0.37
TP53 P04637 2/20 0.35
LMNA P02545 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GMNN O75496 1/20 0.34
MAPT P10636 1/20 0.34
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP2D6 P10635 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
MLNR O43193 1/20 0.34
ABCB11 O95342 1/20 0.34
EGFR P00533 1/20 0.34
FYN P06241 1/20 0.34

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
SCHEMBL10885009 0.74 SHBG (0.38) EPHX1TP53LMNAKDM4EGMNN
SCHEMBL2781157 0.71 EPHX1 (0.48) EPHX1DPP4TP53LMNAKDM4E
SCHEMBL18849500 0.71 EPHX1 (0.48) EPHX1DPP4TP53LMNAKDM4E
SCHEMBL23022847 0.70 EPHX1 (0.37) EPHX1DPP4TP53SIGMAR1
SCHEMBL19982043 0.70 EPHX1 (0.37) EPHX1DPP4TP53SIGMAR1
SCHEMBL4238451 0.69 ANPEP (0.36) EPHX1DPP4TP53LMNAKDM4E
SCHEMBL8070691 0.69 EPHX1 (0.59) EPHX1DPP4TP53LMNAKDM4E
SCHEMBL21656667 0.69 EPHX1 (0.59) EPHX1DPP4TP53LMNAKDM4E
SCHEMBL5700121 0.69 EPHX1 (0.59) EPHX1DPP4TP53LMNAKDM4E
Cyclohexane SCHEMBL2492289 0.69 EPHX1 (0.59) EPHX1DPP4TP53LMNAKDM4E

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-104946267-B Aligning agent for liquid crystal, liquid crystal orientation film and its preparation method, liquid crystal display element, phase difference film and its preparation method, polymer and compound JSR株式会社 2019-06-11 CN disclosed
EP-2139337-A1 INHIBITORS OF FIBROBLAST ACTIVATION PROTEIN, AND METHODS OF USE THEREOF Trustees Of Tufts College (US) 2010-01-06 EP disclosed
WO-2008116054-A1 INHIBITORS OF FIBROBLAST ACTIVATION PROTEIN, AND METHODS OF USE THEREOF TRUSTEES OF TUFTS COLLEGE (US) 2008-09-25 WO disclosed
EP-1948243-A2 POLYCATION-POLYANION COMPLEXES, COMPOSITIONS AND METHODS OF USE THEREOF Aeris Therapeutics, Inc. (US) 2008-07-30 EP disclosed
WO-2007055950-A2 POLYCATION-POLYANION COMPLEXES, COMPOSITIONS AND METHODS OF USE THEREOF AERIS THERAPEUTICS, INC. (US) 2007-05-18 WO disclosed