SCHEMBL5060693

SCHEMBL5060693

NC(=S)Cc1ccccc1Br

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.59
TAAR1 Q96RJ0 3/20 0.48
IDO1 P14902 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
MAPK8 P45983 1/20 0.43
CA12 O43570 7/20 0.41
CA1 P00915 7/20 0.41
CA2 P00918 7/20 0.41
CA9 Q16790 7/20 0.41
PARP10 Q53GL7 1/20 0.41
TSHR P16473 1/20 0.36

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
SCHEMBL9629915 0.84 PKM (0.71) PKMTAAR1IDO1TSHR
SCHEMBL8662681 0.80 TAAR1 (0.45) PKMTAAR1IDO1L3MBTL1MAPK8
SCHEMBL14098647 0.78 PKM (0.59) PKMTAAR1MAPK8TSHR
SCHEMBL15866827 0.78 TAAR1 (0.48) TAAR1IDO1MAPK8CA12CA1
SCHEMBL1395809 0.78 MAPK8 (0.50) TAAR1IDO1MAPK8CA12CA1
Hydrochloric Acid SCHEMBL15862747 0.77 IDO1 (0.48) TAAR1IDO1MAPK8CA12CA1
SCHEMBL11785802 0.76 PKM (0.61) PKMTAAR1
SCHEMBL27654573 0.75 PKM (0.55) PKM
SCHEMBL3729261 0.75 MAPK8 (0.51) L3MBTL1MAPK8CA12CA1CA2
SCHEMBL3714040 0.74 PKM (1.00) PKMTAAR1IDO1MAPK8

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-20080119456-A1 Substituted Thiazoleacetic Acid as Crth2 Ligands 7TM PHARMA A/S (DK) 2008-05-22 US disclosed
CN-1980908-A Substituted thiazoleacetic as CRTH2 ligands 7TM PHARMA AS (DK) 2007-06-13 CN disclosed
EP-1758874-A1 SUBSTITUTED THIAZOLEACETIC ACIDS AS CRTH2 LIGANDS 7TM Pharma A/S (DK) 2007-03-07 EP disclosed
WO-2005116001-A1 SUBSTITUTED THIAZOLEACETIC AS CRTH2 LIGANDS 7TM PHARMA A/S (DK) 2005-12-08 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-20080119456-A1 Substituted Thiazoleacetic Acid as Crth2 Ligands HRH1, HRH2, HRH3 PKM 4588/4885TAAR1 90/4885IDO1 3039/4885

“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.