SCHEMBL1887800

SCHEMBL1887800

CS(=O)(=O)c1cccc(Cc2cccc(Br)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.46
EGFR P00533 5/20 0.46
ERBB2 P04626 5/20 0.46
MMP2 P08253 1/20 0.43
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
HSD17B10 Q99714 1/20 0.42
IDO1 P14902 2/20 0.41
AGXT P21549 2/20 0.41
DRD2 P14416 1/20 0.40
PTGER1 P34995 1/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
PTGS2 P35354 1/20 0.40
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 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
SCHEMBL1888995 0.88 CYP19A1 (0.44) EGFRERBB2ALDH1A1GAAHSD17B10
SCHEMBL265696 0.83 PTGS2 (0.46) MMP2ALDH1A1PTGS2AKR1C3AKR1C2
SCHEMBL29595880 0.83 PTGS2 (0.46) MMP2ALDH1A1PTGS2AKR1C3AKR1C2
SCHEMBL17737834 0.81 KMT2A (0.46) TAAR1ALDH1A1GAAHSD17B10IDO1
SCHEMBL9200966 0.79 TAAR1 (0.60) TAAR1ALDH1A1IDO1AGXT
SCHEMBL1889801 0.79 MAOB (0.67) MMP2ALDH1A1
SCHEMBL29411715 0.78 ALDH1A1 (0.46) ALDH1A1GAAHSD17B10DRD2NR1H2
SCHEMBL533931 0.78 ALDH1A1 (0.46) ALDH1A1GAAHSD17B10DRD2NR1H2
SCHEMBL7054313 0.76 ALDH1A1 (0.47) ALDH1A1GAAHSD17B10DRD2
SCHEMBL8233359 0.76 ALDH1A1 (0.47) ALDH1A1GAAHSD17B10DRD2

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-20110112135-A1 Imidazo [1,2-A] Pyridine Compounds WYETH LLC 2011-05-12 US disclosed
CN-101945871-A Imidazo [1,2-a] pyridine compounds WYETH LLC 2011-01-12 CN disclosed
EP-2231660-A1 IMIDAZO [1,2-A] PYRIDINE COMPOUNDS Wyeth LLC (US) 2010-09-29 EP disclosed
WO-2009086123-A1 IMIDAZO [1,2-A] PYRIDINE COMPOUNDS WYETH (US) 2009-07-09 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-20110112135-A1 Imidazo [1,2-A] Pyridine Compounds NR1H2, NR1H3, NR1H4 TAAR1 101/4885EGFR 247/4885ERBB2 365/4885

“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.