SCHEMBL20101562

SCHEMBL20101562

COP(=O)(OC)OC[C@@H]1CCCO1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
POLB P06746 1/20 0.44
ALDH1A1 P00352 2/20 0.41
KMT2A Q03164 4/20 0.38
HPGD P15428 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MEN1 O00255 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
ANPEP P15144 1/20 0.36
TSHR P16473 1/20 0.35

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
SCHEMBL26263091 0.92 LMNA (0.41) LMNAPOLBALDH1A1KMT2AHPGD
SCHEMBL5956975 0.89 LMNA (0.49) LMNAPOLBALDH1A1KMT2AHPGD
SCHEMBL24393531 0.83 LMNA (0.45) LMNAPOLBALDH1A1KMT2AHPGD
SCHEMBL10569697 0.82 LMNA (0.44) LMNAPOLBALDH1A1KMT2ASMN1; SMN2
SCHEMBL21632873 0.81 ALDH1A1 (0.41) ALDH1A1KMT2AHPGDSMN1; SMN2MEN1
SCHEMBL24245269 0.79 LMNA (0.44) LMNAPOLBALDH1A1KMT2AHPGD
SCHEMBL24497709 0.78 EPHX1 (0.30)
SCHEMBL23450919 0.78 LMNA (0.50) LMNAPOLBALDH1A1KMT2ASMN1; SMN2
SCHEMBL10569690 0.78 LMNA (0.46) LMNAPOLBALDH1A1KMT2AHPGD
SCHEMBL17525783 0.78 LMNA (0.50) LMNAPOLBALDH1A1KMT2AHPGD

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-3052107-B1 ORGANIC COMPOUNDS TO TREAT HEPATITIS B VIRUS NOVARTIS AG (CH) 2018-05-02 EP disclosed