SCHEMBL6153417

SCHEMBL6153417

S=C=Nc1cc(Br)ccc1Br

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.37
TLR9 Q9NR96 1/20 0.37
ALDH1A1 P00352 3/20 0.35
ALOX15 P16050 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
ABCB11 O95342 1/20 0.35
NR3C1 P04150 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
HPGD P15428 1/20 0.35
ADRA2C P18825 1/20 0.35
MAOA P21397 1/20 0.35
DRD1 P21728 1/20 0.35
SLC6A4 P31645 1/20 0.35
HTR2B P41595 1/20 0.35
CCR2 P41597 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MIF P14174 1/20 0.33

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
SCHEMBL188261 0.83 ALOX15 (0.38) HSP90AA1TLR9ALDH1A1ALOX15TDP1
SCHEMBL1096281 0.79 NAAA (0.36) ALDH1A1ALOX15TDP1ABCB11NR3C1
SCHEMBL1023402 0.79 MIF (0.34) ALDH1A1ALOX15TDP1ABCB11NR3C1
SCHEMBL19810750 0.79 ALDH1A1 (0.35) ALDH1A1ALOX15TDP1ABCB11NR3C1
SCHEMBL30673505 0.75 ALDH1A1 (0.34) ALDH1A1ALOX15TDP1ABCB11NR3C1
SCHEMBL1095141 0.75 NAAA (0.39) ALDH1A1ALOX15TDP1ABCB11NR3C1
SCHEMBL1457482 0.75 SIGMAR1 (0.44) ALDH1A1ALOX15TDP1ABCB11NR3C1
SCHEMBL1457687 0.75 ALDH1A1 (0.34) ALDH1A1ALOX15TDP1ABCB11NR3C1
SCHEMBL29123911 0.75 ALDH1A1 (0.33) ALDH1A1ALOX15TDP1ABCB11NR3C1
SCHEMBL6113969 0.75 APLNR (0.40) ALDH1A1TDP1CYP3A4HPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250084759-A1 FLUORESCENT DYE OIL TRACER COMPOSITIONS SAUDI ARABIAN OIL COMPANY (SA) 2025-03-13 US claimed
US-20250084759-A1 FLUORESCENT DYE OIL TRACER COMPOSITIONS SAUDI ARABIAN OIL COMPANY (SA) 2025-03-13 US disclosed
US-12188350-B2 Fluorescent dye oil tracer compositions SAUDI ARABIAN OIL COMPANY (SA) 2025-01-07 US disclosed
US-20230399942-A1 FLUORESCENT DYE OIL TRACER COMPOSITIONS SAUDI ARABIAN OIL COMPANY (SA) 2023-12-14 US disclosed
US-20230399942-A1 FLUORESCENT DYE OIL TRACER COMPOSITIONS SAUDI ARABIAN OIL COMPANY (SA) 2023-12-14 US disclosed
US-20230399942-A1 FLUORESCENT DYE OIL TRACER COMPOSITIONS SAUDI ARABIAN OIL COMPANY (SA) 2023-12-14 US disclosed
US-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2005-03-24 US disclosed
EP-1446110-A2 ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES Structural Bioinformatics Inc. (US) 2004-08-18 EP disclosed
WO-2003032916-A2 ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES STRUCTURAL BIOINFORMATICS INC. (US) 2003-04-24 WO 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-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases PTPRS, PTPRJ, PTPRCAP HSP90AA1 575/4885TLR9 3584/4885ALDH1A1 961/4885

“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.