Picloxydine

Picloxydine

SCHEMBL28086158

N=C(NC(=N)N1CCN(C(=N)NC(=N)Nc2ccc(Cl)cc2)CC1)Nc1ccc(Cl)cc1.O[Bi]1Oc2c(Br)c(Br)c(Br)c(Br)c2O1

nearest known ligand 0.35

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
FAAH O00519 1/20 0.33
HTT P42858 3/20 0.32
MAPK1 P28482 2/20 0.32
MAPT P10636 2/20 0.32
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32
ALDH1A1 P00352 2/20 0.32
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
GAA P10253 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
Picloxydine SCHEMBL467452 0.82 LMNA (0.47) LMNASMN1; SMN2NPSR1MEN1KMT2A
Picloxydine SCHEMBL1705519 0.81 LMNA (0.46) LMNASMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL14705941 0.77 SMN1; SMN2 (0.57) LMNASMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL17777463 0.76 LMNA (0.60) LMNASMN1; SMN2NPSR1MEN1KMT2A
Hydrochloric Acid SCHEMBL23035310 0.76 SMN1; SMN2 (0.55) LMNASMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL14705741 0.76 LMNA (0.58) LMNASMN1; SMN2NPSR1MEN1KMT2A
Hydrochloric Acid SCHEMBL23035338 0.74 LMNA (0.56) LMNASMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL17356925 0.71 LMNA (0.50) LMNASMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL17777326 0.71 KMT2A (0.49) LMNASMN1; SMN2KMT2AMAPTALDH1A1
SCHEMBL17356957 0.69 LMNA (0.62) LMNASMN1; SMN2NPSR1MEN1KMT2A

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
CN-103717597-B Heterocyclic compounds as kinase inhibitors 原真股份有限公司 2017-07-04 CN disclosed
CN-103492389-B Pyrazolo [4,3-d] pyrimidine as inhibitors of kinases 原真股份有限公司 2016-09-14 CN disclosed