SCHEMBL16503259

SCHEMBL16503259

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

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGES O14684 10/20 0.48
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
LRRK2 Q5S007 2/20 0.40
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
TAS1R2 Q8TE23 1/20 0.39
HTR4 Q13639 1/20 0.39
HDAC11 Q96DB2 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
SCHEMBL16352234 1.00 PTGES (0.48) PTGESSMN1; SMN2MAPTRAB9ACNR1
SCHEMBL16352233 0.94 PTGES (0.50) PTGESSMN1; SMN2MAPTRAB9ALRRK2
SCHEMBL16503258 0.94 PTGES (0.50) PTGESSMN1; SMN2MAPTRAB9ALRRK2
SCHEMBL16318409 0.93 PTGES (0.48) PTGESRAB9ACNR1CNR2HTR4
SCHEMBL1976318 0.91 PTGES (0.59) PTGESLRRK2
SCHEMBL16509572 0.91 PTGES (0.59) PTGESLRRK2
SCHEMBL16318593 0.91 PTGES (0.51) PTGESRAB9ALRRK2HTR4HDAC11
SCHEMBL16352179 0.90 PTGES (0.58) PTGESRAB9ACNR2
SCHEMBL16352209 0.88 PTGES (0.46) PTGESSMN1; SMN2MAPTRAB9ACNR1
SCHEMBL16318435 0.87 PTGES (0.49) PTGESSMN1; SMN2RAB9AHTR4HDAC11

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.