SCHEMBL7654943

SCHEMBL7654943

CON=C(C(C)=NN)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 3/20 0.38
TYMP P19971 1/20 0.36
GAA P10253 1/20 0.36
CYP2C19 P33261 1/20 0.36
TSHR P16473 1/20 0.35
NPC1 O15118 4/20 0.34
RAB9A P51151 4/20 0.34
CDK5 Q00535 2/20 0.34
CDK5R1 Q15078 2/20 0.34
PKM P14618 1/20 0.34
HIF1A Q16665 1/20 0.33
ALDH1A1 P00352 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
GLA P06280 1/20 0.33

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
SCHEMBL8078920 1.00 LMNA (0.39) LMNAL3MBTL1MAPK1HTTMAPT
SCHEMBL8460844 0.83 GAA (0.41) LMNAL3MBTL1MAPK1HTTMAPT
SCHEMBL5597826 0.83 GAA (0.41) LMNAL3MBTL1MAPK1HTTMAPT
SCHEMBL6544654 0.82 SMN1; SMN2 (0.42) LMNAHTTNPC1RAB9APKM
SCHEMBL7205062 0.82 LMNA (0.40) LMNAL3MBTL1MAPTCYP2C19NPC1
SCHEMBL7205061 0.82 LMNA (0.40) LMNAL3MBTL1MAPTCYP2C19NPC1
SCHEMBL2045476 0.82 TSHR (0.44) LMNAL3MBTL1MAPK1HTTMAPT
SCHEMBL2045474 0.82 TSHR (0.44) LMNAL3MBTL1MAPK1HTTMAPT
SCHEMBL7651351 0.77 CES1 (0.48) LMNAL3MBTL1MAPK1HTTMAPT
SCHEMBL7805644 0.77 CES1 (0.48) LMNAL3MBTL1MAPK1HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6420362-B1 Azines containing the 5,6-di-hydro-(1,4,2) dioxazine-3-yl group and the use thereof as fungicides BAYER AKTIENGESELLSCHAFT (DE) 2002-07-16 US disclosed
US-6410600-B1 CONTROLLING MICROORGANISMS BAYER AKTIENGESELLSCHAFT (DE) 2002-06-25 US disclosed
EP-1023275-A1 AZINES CONTAINING THE 5,6-DI-HYDRO-(1,4,2) DIOXAZINE-3-YL GROUP AND THE USE THEREOF AS FUNGICIDES BAYER AG (DE) 2000-08-02 EP disclosed
WO-1999019311-A1 AZINES CONTAINING THE 5,6-DI-HYDRO-(1,4,2) DIOXAZINE-3-YL GROUP AND THE USE THEREOF AS FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-04-22 WO disclosed