Bromide

Bromide

SCHEMBL3538499

Br.COc1ccc(C2CCc3nc(NC(=N)N)sc3C2)cc1

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.51
RXFP1 Q9HBX9 1/20 0.48
LMNA P02545 9/20 0.48
ALDH1A1 P00352 6/20 0.48
MAPK1 P28482 3/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
GAA P10253 2/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 6/20 0.44
HTT P42858 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
THRB P10828 3/20 0.43
POLB P06746 2/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
USP2 O75604 1/20 0.41

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
SCHEMBL13314827 0.99 MAPT (0.52) MAPTRXFP1LMNAALDH1A1MAPK1
SCHEMBL3534563 0.99 MAPT (0.52) MAPTRXFP1LMNAALDH1A1MAPK1
SCHEMBL13314851 0.87 LMNA (0.46) MAPTLMNAALDH1A1MAPK1TDP1
SCHEMBL3534984 0.87 LMNA (0.46) MAPTLMNAALDH1A1MAPK1TDP1
SCHEMBL3544686 0.87 MAPT (0.48) MAPTRXFP1LMNAALDH1A1MAPK1
SCHEMBL13314854 0.87 MAPT (0.48) MAPTRXFP1LMNAALDH1A1MAPK1
SCHEMBL3535979 0.86 MAPT (0.46) MAPTRXFP1LMNAALDH1A1MAPK1
SCHEMBL13314842 0.86 MAPT (0.46) MAPTRXFP1LMNAALDH1A1MAPK1
Bromide SCHEMBL3537494 0.86 MAPT (0.45) MAPTLMNAALDH1A1MAPK1TDP1
SCHEMBL3536144 0.84 MAPT (0.46) MAPTLMNAALDH1A1MAPK1TDP1

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-7727979-B2 Guanidine derivatives and their use as neuropeptide FF receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2010-06-01 US disclosed
US-20060194788-A1 Guanidine derivatives and their use as neuropeptide ff receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2006-08-31 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 (1 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-20060194788-A1 Guanidine derivatives and their use as neuropeptide ff receptor antagonists NPFFR1, OGFR, NPFFR2 MAPT 1891/4885RXFP1 38/4885LMNA 2988/4885

“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.