SCHEMBL7845307

SCHEMBL7845307

C1CCC([C]2N=NN=N2)CC1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
CYP11B2 P19099 1/20 0.32
TDO2 P48775 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 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
SCHEMBL7853874 1.00 NISCH (0.34) NISCHALDH1A1KDM4EHPGDHSD17B10
SCHEMBL7852067 1.00 NISCH (0.34) NISCHALDH1A1KDM4EHPGDHSD17B10
SCHEMBL7853970 0.97 NISCH (0.31) NISCHALDH1A1KDM4EHPGDHSD17B10
SCHEMBL7856955 0.91
SCHEMBL7845159 0.69 CYP11B2 (0.35) NISCHALDH1A1KDM4EHPGDHSD17B10
SCHEMBL7856562 0.69 CYP11B2 (0.35) NISCHALDH1A1KDM4EHPGDHSD17B10
SCHEMBL7852189 0.69 CYP11B2 (0.35) NISCHALDH1A1KDM4EHPGDHSD17B10
SCHEMBL7852487 0.67 CYP11B2 (0.31) CYP11B2TDO2
SCHEMBL7853912 0.67 CYP11B2 (0.31) CYP11B2TDO2
SCHEMBL7854523 0.67 CYP11B2 (0.31) CYP11B2TDO2

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
EP-0719258-B1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMA CO LTD (JP) 2001-10-31 EP disclosed
US-5786367-A OXYGEN SCAVENGERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US disclosed
EP-0719258-A1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-07-03 EP disclosed
WO-1996002508-A1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-02-01 WO disclosed