SCHEMBL9316153

SCHEMBL9316153

C=CCN1CNc2ccccc21.COS(=O)(=O)O

nearest known ligand 0.39

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.39
BRPF1 P55201 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
ALDH1A1 P00352 5/20 0.32
KDM4E B2RXH2 3/20 0.32
TSHR P16473 2/20 0.32
GRIA1 P42261 1/20 0.32
GRIA2 P42262 1/20 0.32
GRIA3 P42263 1/20 0.32
GRIA4 P48058 1/20 0.32
HSD17B3 P37058 1/20 0.32
MMP13 P45452 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
MEN1 O00255 1/20 0.31
ALPL P05186 1/20 0.31
ALPI P09923 1/20 0.31
MAPT P10636 1/20 0.31
ALPG P10696 1/20 0.31
KMT2A Q03164 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
SCHEMBL7544166 0.84 GAA (0.42) GAABRPF1ALDH1A1KDM4EGRIA1
SCHEMBL8039565 0.74 BRPF1 (0.39) GAABRPF1HSD17B3MEN1KMT2A
SCHEMBL9544934 0.73 MEN1 (0.36) ALDH1A1KDM4ETSHRGRIA1GRIA2
SCHEMBL8524767 0.70 HRH3 (0.40) GAAALDH1A1KDM4ETSHRGRIA1
SCHEMBL8756210 0.69 KMT2A (0.43) GAAALDH1A1KDM4ETSHRGRIA1
SCHEMBL9868798 0.68 GRIA2 (0.44) GAABRPF1ALDH1A1GRIA2HSD17B3
SCHEMBL28176871 0.68 BRPF1 (0.40) GAABRPF1ALDH1A1KDM4EHSD17B3
SCHEMBL29169523 0.68 GAA (0.31) GAABRPF1EPHX2
SCHEMBL6450576 0.68 BRPF1 (0.44) GAABRPF1ALDH1A1KDM4EHSD17B3
SCHEMBL6690571 0.67 BRPF1 (0.35) GAABRPF1HSD17B3MEN1KMT2A

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-0579701-A1 PROCESS FOR THE METALLIZATION OF NON-CONDUCTORS, IN PARTICULAR CIRCUIT BOARDS, AND THE USE OF NITROGEN-CONTAINING QUATERNARY SALTS IN THE PROCESS. ATOTECH DEUTSCHLAND GMBH (DE) 1994-01-26 EP disclosed
WO-1992019091-A1 PROCESS FOR THE METALLIZATION OF NON-CONDUCTORS, IN PARTICULAR CIRCUIT BOARDS, AND THE USE OF NITROGEN-CONTAINING QUATERNARY SALTS IN THE PROCESS ATOTECH DEUTSCHLAND GMBH (DE) 1992-10-29 WO disclosed