SCHEMBL18698136

SCHEMBL18698136

Brc1cccc(Br)c1N(c1ccccc1)c1nc2ccccc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
BCHE P06276 2/20 0.40
ACHE P22303 1/20 0.40
ALDH1A1 P00352 3/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
KDM4E B2RXH2 1/20 0.40
ABCB11 O95342 1/20 0.40
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GAA P10253 2/20 0.39
HPGD P15428 1/20 0.39
MCL1 Q07820 1/20 0.39
POLB P06746 2/20 0.39

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
SCHEMBL18698150 0.85 LMNA (0.48) LMNACYP1A2CYP2D6CYP2C19BCHE
SCHEMBL5814537 0.84 LMNA (0.59) LMNACYP1A2CYP2D6CYP2C19BCHE
SCHEMBL27397925 0.84 LMNA (0.59) LMNACYP1A2CYP2D6CYP2C19BCHE
SCHEMBL18687134 0.78 LMNA (0.43) LMNACYP1A2CYP2D6CYP2C19BCHE
SCHEMBL22227972 0.77 LMNA (0.61) LMNACYP1A2CYP2D6CYP2C19BCHE
SCHEMBL27398015 0.76 NPC1 (0.49) LMNACYP1A2CYP2D6CYP2C19BCHE
SCHEMBL17150252 0.73 LMNA (0.51) LMNACYP1A2CYP2D6CYP2C19BCHE
SCHEMBL27397970 0.72 LMNA (0.53) LMNACYP1A2CYP2D6CYP2C19BCHE
SCHEMBL18083396 0.72 LMNA (0.45) LMNACYP1A2CYP2D6CYP2C19BCHE
SCHEMBL8573940 0.71 LMNA (0.51) LMNACYP1A2CYP2D6CYP2C19BCHE

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-3150604-B1 BENZIMIDAZOLO[1,2-A]BENZIMIDAZOLE CARRYING BENZIMIDAZOLO[1,2-A]BENZIMIDAZOLYLYL GROUPS, CARBAZOLYL GROUPS, BENZOFURANE GROUPS OR BENZOTHIOPHENE GROUPS FOR ORGANIC LIGHT EMITTING DIODES IDEMITSU KOSAN CO (JP) 2021-07-14 EP disclosed
EP-3150604-A1 BENZIMIDAZOLO[1,2-A]BENZIMIDAZOLE CARRYING BENZIMIDAZOLO[1,2-A]BENZIMIDAZOLYL GROUPS, CARBAZOLYL GROUPS, BENZOFURANE GROUPS OR BENZOTHIOPHENE GROUPS FOR ORGANIC LIGHT EMITTING DIODES IDEMITSU KOSAN CO., LTD. (JP) 2017-04-05 EP disclosed