SCHEMBL47341

SCHEMBL47341

NCNC(=O)C1CCSCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
HSD17B10 Q99714 1/20 0.41
KMT2A Q03164 2/20 0.39
EPHX1 P07099 1/20 0.38
POLB P06746 1/20 0.35
USP2 O75604 2/20 0.33
HPGD P15428 2/20 0.33
ALDH1A1 P00352 1/20 0.33
NAAA Q02083 1/20 0.33
GNAI3 P08754 2/20 0.33
GNAO1 P09471 2/20 0.33
GNAI1 P63096 2/20 0.33
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
MTNR1A P48039 1/20 0.31
TRPA1 O75762 1/20 0.31
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CTSK P43235 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL7877130 0.84
Hydrochloric Acid SCHEMBL22394902 0.82
SCHEMBL14026314 0.80
Hydrochloric Acid SCHEMBL28929577 0.78 SMN1; SMN2 (0.53) SMN1; SMN2HSD17B10KMT2AEPHX1USP2
SCHEMBL47365 0.78 EPHX1 (0.61) SMN1; SMN2HSD17B10KMT2AEPHX1USP2
SCHEMBL14277709 0.76 HDAC8 (0.34) KMT2APOLBHDAC8HDAC6
SCHEMBL25990500 0.75 SMN1; SMN2 (0.46) SMN1; SMN2HSD17B10KMT2AEPHX1POLB
SCHEMBL47355 0.75 SMN1; SMN2 (0.41) SMN1; SMN2HSD17B10KMT2AEPHX1POLB
SCHEMBL24474315 0.75 ROCK2 (0.46) SMN1; SMN2HSD17B10KMT2AEPHX1POLB
SCHEMBL30606193 0.71 CHRNB2 (0.42) SMN1; SMN2HSD17B10KMT2APOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2582696-B1 5-ARYL ISOXAZOLINES FOR CONTROLLING PESTS NOVARTIS AG (CH) 2014-10-22 EP disclosed
WO-2011157748-A1 5-ARYL ISOXAZOLINES FOR CONTROLLING PESTS NOVARTIS AG (CH) 2011-12-22 WO disclosed