SCHEMBL9699285

SCHEMBL9699285

CC(=O)c1cccc2c(Br)cc(Br)cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
MAOB P27338 1/20 0.41
TSHR P16473 2/20 0.40
PRNP P04156 1/20 0.40
GAA P10253 1/20 0.40
NSD2 O96028 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
MCL1 Q07820 1/20 0.40
AHR P35869 1/20 0.39
RXFP1 Q9HBX9 1/20 0.38
HSPD1 P10809 2/20 0.37
HSPE1 P61604 2/20 0.37
BRPF1 P55201 1/20 0.37
PBRM1 Q86U86 1/20 0.36
CYP1A2 P05177 1/20 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
SCHEMBL9700491 0.84 PRNP (0.53) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL9700317 0.82 PTPN1 (0.38) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL8060924 0.82 PRNP (0.40) MEN1KMT2AALDH1A1HPGDPRNP
Hydrochloric Acid SCHEMBL9700325 0.82 PRNP (0.51) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL1294284 0.81 KMT2A (0.59) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL30530505 0.81 KMT2A (0.59) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL7119411 0.76 KDM4E (0.55) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL38573232 0.76 KDM4E (0.55) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL4537274 0.75 MEN1 (0.45) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL28769249 0.74 MAPT (0.46) MEN1KMT2AKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5112820-A Vision defects STERLING DRUG INC. (US) 1992-05-12 US disclosed
US-5109135-A 2- or 3-aminomethyl-4-amino-3,4-dihydro-2H-1,4-benzoxazine intermediates STERLING DRUG INC. (US) 1992-04-28 US disclosed
US-5066803-A Chemical intermediates for analgesics STERLING DRUG INC. (US) 1991-11-19 US disclosed
WO-1990007505-A1 2- AND 3-AMINOMETHYL-6-ARYLCARBONYL-2,3-DIHYDROPYRROLO[1,2,3-de]-1,4-BENZOXAZINES STERLING DRUG INC. (US) 1990-07-12 WO disclosed
US-4939138-A 2- and 3-aminomethyl-6-arylcarbonyl-2,3-dihydropyrrolo(1,2,3-DE)-1,4-benzoxazines STERLING DRUG INC. (US) 1990-07-03 US disclosed