SCHEMBL7635104

SCHEMBL7635104

C[N+](C)(c1ccccc1)c1ccccc1.C[N+](C)(c1ccccc1)c1ccccc1.[H+].[O-]B([O-])[O-]

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.48
APOBEC3G Q9HC16 1/20 0.48
ALDH1A1 P00352 4/20 0.35
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 4/20 0.32
KDM4E B2RXH2 1/20 0.32
ACHE P22303 2/20 0.30
TSHR P16473 1/20 0.30
ALOX12 P18054 1/20 0.30

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
SCHEMBL7637767 0.97 APOBEC3A (0.50) APOBEC3AAPOBEC3GALDH1A1LMNAHSD17B10
SCHEMBL11811411 0.87 APOBEC3A (0.46) APOBEC3AAPOBEC3GALDH1A1LMNAHSD17B10
SCHEMBL1684199 0.86 APOBEC3A (0.61) APOBEC3AAPOBEC3GALDH1A1LMNATDP1
SCHEMBL12020265 0.86 APOBEC3A (0.61) APOBEC3AAPOBEC3GALDH1A1LMNATDP1
Tetramethylammonium Ion SCHEMBL7636638 0.84 APOBEC3A (0.48) APOBEC3AAPOBEC3GALDH1A1LMNAHSD17B10
Tetramethylammonium Ion SCHEMBL7638090 0.84 APOBEC3A (0.48) APOBEC3AAPOBEC3GALDH1A1LMNAHSD17B10
SCHEMBL7639305 0.84 APOBEC3A (0.48) APOBEC3AAPOBEC3GALDH1A1LMNAHSD17B10
Bromide SCHEMBL5092593 0.83 APOBEC3A (0.58) APOBEC3AAPOBEC3GALDH1A1LMNATDP1
Water SCHEMBL994455 0.83 APOBEC3A (0.58) APOBEC3AAPOBEC3GALDH1A1LMNATDP1
Hydrochloric Acid SCHEMBL2320632 0.83 APOBEC3A (0.58) APOBEC3AAPOBEC3GALDH1A1LMNATDP1

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
US-20020103328-A1 Aromatic polycarbonate composition, production process therefor and molded product thereof TEIJIN LIMITED 2002-08-01 US disclosed