SCHEMBL5034819

SCHEMBL5034819

O=C(c1cc2c(Br)cccc2o1)c1cc2c(Br)cccc2o1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 4/20 0.52
NPC1 O15118 5/20 0.46
RAB9A P51151 4/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
MCL1 Q07820 1/20 0.44
TSHR P16473 4/20 0.42
CSNK2A1 P68400 3/20 0.42
MAPK1 P28482 3/20 0.42
KDM4E B2RXH2 2/20 0.42
CSNK2A2 P19784 2/20 0.42
CSNK2B P67870 2/20 0.42
CSNK2A3 Q8NEV1 2/20 0.42
USP2 O75604 2/20 0.42
PTGS1 P23219 1/20 0.42
CYP2C19 P33261 2/20 0.41
MAPT P10636 4/20 0.40
HPGD P15428 3/20 0.40
HSD17B10 Q99714 2/20 0.40
GLA P06280 1/20 0.40

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
SCHEMBL1893419 0.87 MCL1 (0.58) NPC1RAB9AMEN1KMT2AMCL1
SCHEMBL21951007 0.86 KDM4E (0.54) NPC1RAB9AMEN1KMT2AMCL1
SCHEMBL3215728 0.82 NPC1 (0.45) FLT3NPC1RAB9AMEN1KMT2A
SCHEMBL29144469 0.82 KDM4E (0.48) NPC1RAB9AMEN1KMT2ATSHR
SCHEMBL3209550 0.80 SRD5A2 (0.48) NPC1RAB9AMEN1KMT2ATSHR
SCHEMBL1851902 0.79 MCL1 (0.44) FLT3NPC1RAB9AMEN1KMT2A
SCHEMBL3210023 0.79 NPC1 (0.42) NPC1RAB9AMEN1KMT2AMCL1
SCHEMBL8440469 0.78 MAOB (0.53) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL16632533 0.74 MAOA (0.37) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL1852042 0.74 SRD5A2 (0.41) MEN1KMT2AMAPTHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080221191-A1 Cationic substituted benzofurans as antimicrobial agents NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-09-11 US disclosed
US-7417158-B2 Mycobacterium tuberculosis infection; protozoan pathogens; fungal pathogens THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2008-08-26 US disclosed
US-20080114047-A1 Cationic substituted benzofurans as antimicrobial agents NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-05-15 US disclosed
US-20050197378-A1 Cationic substituted benzofurans as antimicrobial agents TIDWELL RICHARD R (US) 2005-09-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080114047-A1 Cationic substituted benzofurans as antimicrobial agents BET1, ARG2, BRDT FLT3 1964/4885NPC1 386/4885RAB9A 2992/4885
US-20050197378-A1 Cationic substituted benzofurans as antimicrobial agents BET1, ARG2, BRDT FLT3 1964/4885NPC1 386/4885RAB9A 2992/4885
US-20080221191-A1 Cationic substituted benzofurans as antimicrobial agents BET1, ARG2, BRDT FLT3 1964/4885NPC1 386/4885RAB9A 2992/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.