SCHEMBL17690666

SCHEMBL17690666

N[C@@H](CO)C(=O)NC1CCC(O)CC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.50
LMNA P02545 1/20 0.42
BLM P54132 1/20 0.42
KMT2A Q03164 1/20 0.41
ARG1 P05089 1/20 0.39
ARG2 P78540 1/20 0.39
SMYD3 Q9H7B4 1/20 0.38
HRH2 P25021 1/20 0.37
HRH1 P35367 1/20 0.37
SOS1 Q07889 2/20 0.34
KRAS P01116 1/20 0.34
FUCA1 P04066 1/20 0.33
METAP1 P53582 1/20 0.33
CTSD P07339 1/20 0.32
PKM P14618 1/20 0.32
MMP2 P08253 1/20 0.31
MMP8 P22894 1/20 0.31
MFN2 O95140 1/20 0.31

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
SCHEMBL13457724 1.00 EPHX2 (0.50) EPHX2LMNABLMKMT2AARG1
SCHEMBL17690627 1.00 EPHX2 (0.50) EPHX2LMNABLMKMT2AARG1
Hydrochloric Acid SCHEMBL5114605 0.90 LMNA (0.45) EPHX2LMNABLMKMT2AARG1
Hydrochloric Acid SCHEMBL29244862 0.90 LMNA (0.45) EPHX2LMNABLMKMT2AARG1
SCHEMBL15906222 0.84 EPHX1 (0.46) LMNABLMKMT2AARG1ARG2
SCHEMBL15906224 0.84 EPHX1 (0.46) LMNABLMKMT2AARG1ARG2
SCHEMBL18459935 0.83 EPHX1 (0.48) EPHX2LMNABLMKMT2AMMP2
SCHEMBL18459934 0.83 EPHX1 (0.48) EPHX2LMNABLMKMT2AMMP2
Hydrochloric Acid SCHEMBL9718091 0.81 EPHX1 (0.47) EPHX2LMNABLMKMT2AMMP2
SCHEMBL14652087 0.81 LMNA (0.42) LMNABLMKMT2AARG1ARG2

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-2321272-B1 ORGANIC COMPOUNDS NABRIVA THERAPEUTICS AG (AT) 2016-04-20 EP disclosed