SCHEMBL3258402

SCHEMBL3258402

C=CCc1nc2c(C)cccc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MGAM O43451 15/20 0.45
GAA P10253 15/20 0.45
SI P14410 15/20 0.45
MGAM2 Q2M2H8 15/20 0.45
ALDH1A1 P00352 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ESR1 P03372 1/20 0.43
CBFB Q13951 1/20 0.43

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
SCHEMBL2163311 0.82 MAPT (0.40)
SCHEMBL9697197 0.82 PSMD14 (0.34) GAAALDH1A1TDP1
SCHEMBL4359045 0.81 MGAM (0.51) MGAMGAASIMGAM2ALDH1A1
SCHEMBL4633990 0.81 CHEK1 (0.50) GAAALDH1A1TDP1
SCHEMBL10634828 0.81 GRIN2B (0.50) MGAMGAASIMGAM2ALDH1A1
SCHEMBL4919548 0.80 DDAH1 (0.55) MGAMGAASIMGAM2ALDH1A1
SCHEMBL30518181 0.80 DDAH1 (0.55) MGAMGAASIMGAM2ALDH1A1
SCHEMBL4062820 0.78 MGAM (0.51) MGAMGAASIMGAM2ALDH1A1
SCHEMBL7409334 0.78 MGAM (0.49) MGAMGAASIMGAM2ALDH1A1
SCHEMBL4346855 0.78 MGAM (0.51) MGAMGAASIMGAM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4099285-A None JP disclosed
EP-2161354-A1 COPPER SURFACE TREATING AGENT AND SURFACE TREATMENT METHOD MEC COMPANY LTD. (JP) 2010-03-10 EP disclosed
EP-0818562-A1 Composition for treating copper and copper alloy surfaces and method for the surface treatment MEC CO., Ltd. (JP) 1998-01-14 EP disclosed
US-5173130-A Immersing copper or alloy to be soldered in an aqueous solution containing a 2-alkylbenzimidazole and an organic acid to form a corrosion and heat resistant protective coating SHIKOKU CHEMICALS CORPORATION (JP) 1992-12-22 US disclosed
JP-H0499285-A SURFACE TREATMENT OF COPPER AND COPPER ALLOY SHIKOKU CHEM CORP 1992-03-31 JP disclosed
EP-0428383-A1 Process for surface treatment of copper and copper alloy SHIKOKU CHEMICALS CORPORATION (JP) 1991-05-22 EP disclosed