SCHEMBL9769252

SCHEMBL9769252

[O-][n+]1c(C(Br)(Br)Br)ncc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.45
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 1/20 0.31
GPR3 P46089 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
PDPK1 O15530 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
SCHEMBL9769436 0.84 ATM (0.44) ATMNPC1RAB9A
SCHEMBL4620642 0.73 ATM (0.48) ATMNPC1RAB9AKDM4EGPR3
SCHEMBL8424490 0.73 ATM (0.48) ATMNPC1RAB9AKDM4EGPR3
SCHEMBL3535166 0.73 ATM (0.48) ATMNPC1RAB9AKDM4EGPR3
SCHEMBL4559941 0.73 ATM (0.48) ATMNPC1RAB9AKDM4EGPR3
SCHEMBL5259264 0.73 ATM (0.48) ATMNPC1RAB9AKDM4EGPR3
SCHEMBL6081734 0.73 ATM (0.44) ATMNPC1RAB9A
SCHEMBL5250885 0.70 ATM (0.45) ATMNPC1RAB9AKDM4EGPR3
SCHEMBL400031 0.69 ATM (0.40) ATMNPC1RAB9AKDM4E
SCHEMBL8626591 0.69 ATM (0.40) ATMNPC1RAB9AKDM4ECYP1A2

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
US-5030548-A Photoiniator system comprising a 4,4'-bis(dialkylamino) benzophenone, an aromatic ketone and lophine dimer; also present a halogen compound leuco and dye; lithography; printing plates; photoresists FUJI PHOTO FILM CO., LTD. (JP) 1991-07-09 US disclosed
US-4584260-A 4,41-BIS(DIALKYLAMINO)BENZOPHENONE A BENZOPHENONE, 1,3,4-OXADIAZOLE COMPOUND, AROMATIC HALOGENATED SULFONE, QUINAZOLINE AND TRIAZINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1986-04-22 US disclosed