SCHEMBL4357078

SCHEMBL4357078

CC(C)Cn1cc(-c2nc(C(=O)O)cs2)c2cc(Cl)ccc21

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 6/20 0.45
TBXA2R P21731 1/20 0.42
PTGER3 P43115 1/20 0.42
ACHE P22303 1/20 0.41
PTPN1 P18031 1/20 0.40
ADRB2 P07550 2/20 0.40
ADRB1 P08588 2/20 0.40
ADRB3 P13945 2/20 0.40
EIF4EBP1 Q13541 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ICMT O60725 1/20 0.39
SHMT1 P34896 1/20 0.39
SHMT2 P34897 1/20 0.39
PANK3 Q9H999 1/20 0.39

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
SCHEMBL4037638 0.87 RAB9A (0.44) PTGER1ALDH1A1
SCHEMBL3595139 0.81 PTGER1 (0.41) PTGER1TBXA2RPTGER3ADRB2ADRB1
SCHEMBL13631464 0.77 PTGER1 (0.34) PTGER1TBXA2RPTGER3ICMT
SCHEMBL3596003 0.76 ICMT (0.46) ICMT
SCHEMBL3594920 0.74 PTGER1 (0.41) PTGER1TBXA2RPTGER3ICMT
SCHEMBL3592829 0.74 ICMT (0.41) PTGER1TBXA2RPTGER3ALDH1A1ICMT
SCHEMBL31140510 0.73 KCNH2 (0.48) ALDH1A1ICMT
SCHEMBL20769701 0.72 ICMT (0.57) ALDH1A1ICMT
SCHEMBL3588680 0.71 ICMT (0.46) PTGER1ALDH1A1ICMT
SCHEMBL4354618 0.71 KDM4E (0.36) PTGER1ADRB2ADRB1ADRB3ALDH1A1

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-20090281152-A1 Indole Compounds Having Affinity to the EP1 Receptor GLAXO GROUP LIMITED (GB) 2009-11-12 US disclosed
US-20090281152-A1 Indole Compounds Having Affinity to the EP1 Receptor GLAXO GROUP LIMITED (GB) 2009-11-12 US disclosed
US-20090281152-A1 Indole Compounds Having Affinity to the EP1 Receptor GLAXO GROUP LIMITED (GB) 2009-11-12 US disclosed
WO-2008006794-A1 INDOLE COMPOUNDS HAVING AFFINITY TO THE EP1 RECEPTOR GLAXO GROUP LIMITED (GB) 2008-01-17 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-20090281152-A1 Indole Compounds Having Affinity to the EP1 Receptor PTGER1, PTGER2, PTGER3 PTGER1 1/4885TBXA2R 16/4885PTGER3 3/4885

“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.