SCHEMBL16503258

SCHEMBL16503258

COc1cc2[nH]c(Nc3c(Cl)ccc(Cl)c3F)nc2cc1C(=O)NC1CCC(C)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGES O14684 10/20 0.50
SMN1; SMN2 Q16637 1/20 0.45
MAPT P10636 1/20 0.44
RAB9A P51151 2/20 0.43
LRRK2 Q5S007 2/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
HTR4 Q13639 1/20 0.41
CRHR1 P34998 1/20 0.41
HDAC11 Q96DB2 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL16352233 1.00 PTGES (0.50) PTGESSMN1; SMN2MAPTRAB9ALRRK2
SCHEMBL16503259 0.94 PTGES (0.48) PTGESSMN1; SMN2MAPTRAB9ALRRK2
SCHEMBL16352234 0.94 PTGES (0.48) PTGESSMN1; SMN2MAPTRAB9ALRRK2
SCHEMBL16318435 0.92 PTGES (0.49) PTGESSMN1; SMN2RAB9AHTR4HDAC11
SCHEMBL16509616 0.91 PTGES (0.61) PTGESLRRK2CRHR1
SCHEMBL16503254 0.91 PTGES (0.51) PTGESRAB9ALRRK2CRHR1
SCHEMBL1973380 0.91 PTGES (0.61) PTGESLRRK2CRHR1
SCHEMBL16352218 0.91 PTGES (0.51) PTGESRAB9ALRRK2CRHR1
SCHEMBL16352231 0.91 PTGES (0.52) PTGESSMN1; SMN2MAPTRAB9ACRHR1
SCHEMBL16318477 0.91 PTGES (0.48) PTGESRAB9ALRRK2HTR4CRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-12-22 US 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-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents MAPRE2, MAPRE1, H1-4 PTGES 118/4885SMN1; SMN2 3446/4885MAPT 480/4885

“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.