Benzyl Bromide

Benzyl Bromide

SCHEMBL634338

BrCc1ccccc1.Fc1cccc(Cl)c1CBr

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
ALDH1A1 P00352 3/20 0.50
TAAR1 Q96RJ0 1/20 0.50
TRPA1 O75762 1/20 0.50
TSHR P16473 1/20 0.50
GAA P10253 1/20 0.47
HTT P42858 2/20 0.46
ATM Q13315 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KDM4E B2RXH2 3/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
BACE1 P56817 1/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP2A13 Q16696 1/20 0.41
POLB P06746 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
SCHEMBL29713144 0.89 TAAR1 (0.61) LMNATAAR1GAAHTTATM
SCHEMBL4706 0.89 TAAR1 (0.61) LMNATAAR1GAAHTTATM
SCHEMBL11030444 0.87 TAAR1 (0.59) LMNATAAR1GAAHTTATM
SCHEMBL2919993 0.87 TAAR1 (0.59) LMNATAAR1GAAHTTATM
SCHEMBL21971599 0.79 LMNA (0.55) LMNAALDH1A1TAAR1GAAHTT
SCHEMBL7796908 0.74 GAA (0.44) LMNATAAR1GAAHTTATM
SCHEMBL19065126 0.73 KMT2A (0.52) LMNAALDH1A1TAAR1GAAHTT
SCHEMBL121801 0.73 TAAR1 (0.43) ALDH1A1TAAR1TRPA1TSHRGAA
SCHEMBL9770 0.73 TAAR1 (0.50) LMNAALDH1A1TAAR1TSHRGAA
SCHEMBL27737807 0.73 TAAR1 (0.68) LMNATAAR1GAAHTTATM

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-20120095064-A1 (PYRAZOL-3-YL)-1,3,4-THIADIAZOL-2-AMINE AND (PYRAZOL-3-YL)-1,3,4-THIAZOL-2-AMINE COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-04-19 US disclosed
EP-2419426-A1 ( PYRAZOL-3-YL) -1, 3, 4-THIADIAZOL-2-AMINE AND ( PYRAZOL-3-YL) -1, 3, 4-THIAZOL-2-AMINE COMPOUNDS Glaxo Group Limited (GB) 2012-02-22 EP 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-20120095064-A1 (PYRAZOL-3-YL)-1,3,4-THIADIAZOL-2-AMINE AND (PYRAZOL-3-YL)-1,3,4-THIAZOL-2-AMINE COMPOUNDS H1-3, CHRM2, TBL3 LMNA 1822/4885ALDH1A1 2718/4885TAAR1 750/4885

“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.