SCHEMBL9664853

SCHEMBL9664853

COC(=O)c1cc(N(C)C)ccc1C(c1ccccc1N(C)C)c1ccccc1N(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA3 P34903 1/20 0.42
GABRA2 P47869 1/20 0.42
KMT2A Q03164 4/20 0.42
ALDH1A1 P00352 5/20 0.37
MAPT P10636 5/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
GAA P10253 4/20 0.37
TSHR P16473 3/20 0.37
TP53 P04637 1/20 0.37
LMNA P02545 3/20 0.36
KDM4E B2RXH2 5/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
RAB9A P51151 1/20 0.36
NQO2 P16083 1/20 0.36
HSD17B10 Q99714 2/20 0.36

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
SCHEMBL9665836 0.87 PDCD1 (0.38) KMT2AALDH1A1MAPTSMN1; SMN2GAA
SCHEMBL9665847 0.82 GABRG2 (0.39) GABRA1GABRG2GABRB3GABRA3GABRA2
SCHEMBL7187749 0.81 SLC2A1 (0.45) GABRA1GABRG2GABRB3GABRA3GABRA2
SCHEMBL7186547 0.75 ALDH1A1 (0.45) GABRA1GABRG2GABRB3GABRA3GABRA2
SCHEMBL15229760 0.73 GABRG2 (0.58) GABRA1GABRG2GABRB3GABRA3GABRA2
SCHEMBL8762164 0.73 CA12 (0.47) GABRA1GABRG2GABRB3GABRA3GABRA2
SCHEMBL11221718 0.73 TDP1 (0.40) GABRA1GABRG2GABRB3GABRA3GABRA2
SCHEMBL18015088 0.72 KDM4E (0.47) GABRA1GABRG2GABRB3GABRA3GABRA2
SCHEMBL30966775 0.72 KDM4E (0.47) GABRA1GABRG2GABRB3GABRA3GABRA2
SCHEMBL43644 0.71 KMT2A (0.67) KMT2AALDH1A1MAPTSMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0486749-A1 Triarylmethane compounds and pressure sensitive recording material HODOGAYA CHEMICAL CO., LTD. (JP) 1992-05-27 EP disclosed