SCHEMBL7546309

SCHEMBL7546309

B.C[N+](C)(c1ccccc1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.58
APOBEC3G Q9HC16 1/20 0.58
ALDH1A1 P00352 4/20 0.38
TDP1 Q9NUW8 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ACHE P22303 3/20 0.37
TSHR P16473 3/20 0.37
LMNA P02545 2/20 0.37
ALOX12 P18054 1/20 0.37
MAPT P10636 2/20 0.32
CYP3A4 P08684 1/20 0.32
CA4 P22748 2/20 0.32
TP53 P04637 1/20 0.32
INMT O95050 1/20 0.31
CHRM2 P08172 2/20 0.30
CHRM4 P08173 2/20 0.30
CHRM5 P08912 2/20 0.30
CHRM1 P11229 2/20 0.30
CHRM3 P20309 2/20 0.30
CA12 O43570 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
SCHEMBL1684199 0.97 APOBEC3A (0.61) APOBEC3AAPOBEC3GALDH1A1TDP1KDM4E
SCHEMBL12020265 0.97 APOBEC3A (0.61) APOBEC3AAPOBEC3GALDH1A1TDP1KDM4E
Water SCHEMBL994455 0.93 APOBEC3A (0.58) APOBEC3AAPOBEC3GALDH1A1TDP1KDM4E
Hydrochloric Acid SCHEMBL2320632 0.93 APOBEC3A (0.58) APOBEC3AAPOBEC3GALDH1A1TDP1KDM4E
SCHEMBL7546306 0.93 APOBEC3A (0.58) APOBEC3AAPOBEC3GALDH1A1TDP1KDM4E
Bromide SCHEMBL5092593 0.93 APOBEC3A (0.58) APOBEC3AAPOBEC3GALDH1A1TDP1KDM4E
Iodide SCHEMBL5085390 0.93 APOBEC3A (0.67) APOBEC3AAPOBEC3GALDH1A1TDP1KDM4E
Boric Acid SCHEMBL11811405 0.85 APOBEC3A (0.50) APOBEC3AAPOBEC3GALDH1A1TDP1KDM4E
SCHEMBL7637767 0.85 APOBEC3A (0.50) APOBEC3AAPOBEC3GALDH1A1TDP1KDM4E
SCHEMBL7635104 0.83 APOBEC3A (0.48) APOBEC3AAPOBEC3GALDH1A1TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0667366-B1 Process for the production of aromatic polycarbonate TEIJIN LTD (JP) 2002-06-26 EP disclosed
US-5516878-A CATALYTIC ESTER INTERCHANGE USING AN ALKALI METAL SALT OF AN ATE-COMPLEX OF A METAL SELECTED FROM SILICON, GERMANIUM, TIN, OR LEAD TEIJIN LIMITED (JP) 1996-05-14 US disclosed
EP-0667366-A2 Process for the production of aromatic polycarbonate TEIJIN LIMITED (JP) 1995-08-16 EP disclosed