SCHEMBL23735494

SCHEMBL23735494

NC(=O)NC1CCC(NC(=O)NC2CCC(NC(N)=O)CC2)CC1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.61
EPHX1 P07099 12/20 0.56
NPC1 O15118 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
RAB9A P51151 2/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
CYP3A4 P08684 1/20 0.56
MMP2 P08253 1/20 0.41
MMP8 P22894 1/20 0.41
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.39
CYP2D6 P10635 1/20 0.38
POLB P06746 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
SCHEMBL11043155 0.92 EPHX2 (0.48) EPHX2EPHX1NPC1SMN1; SMN2RAB9A
SCHEMBL11043150 0.92 EPHX2 (0.48) EPHX2EPHX1NPC1SMN1; SMN2RAB9A
SCHEMBL687674 0.92
SCHEMBL15277766 0.91 EPHX1 (0.74) EPHX2EPHX1NPC1SMN1; SMN2RAB9A
Hydrochloric Acid SCHEMBL14917782 0.89
SCHEMBL9547538 0.86 EPHX2 (0.78) EPHX2EPHX1NPC1SMN1; SMN2RAB9A
SCHEMBL22686540 0.82 SMYD3 (0.46) EPHX2MMP2MMP8
SCHEMBL23573318 0.82 POLB (0.41) EPHX2EPHX1NPC1SMN1; SMN2RAB9A
SCHEMBL1669802 0.82 EPHX2 (0.65) EPHX2EPHX1NPC1SMN1; SMN2RAB9A
SCHEMBL28189500 0.82 EPHX2 (0.65) EPHX2EPHX1NPC1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3157978-B1 STRICTLY SEGMENTED THERMOPLASTIC ELASTOMERS AS BIODEGRADABLE BIOMATERIALS SYMO CHEM B V (NL) 2021-08-11 EP disclosed