SCHEMBL6315253

SCHEMBL6315253

COc1cc[c]cc1N(C)CC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
KEAP1 Q14145 3/20 0.35
NFE2L2 Q16236 3/20 0.35
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.33
SLC6A9 P48067 1/20 0.33
TSHR P16473 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
GAA P10253 2/20 0.33
HSD17B10 Q99714 1/20 0.33
NFKB1 P19838 1/20 0.33
AKR1B10 O60218 1/20 0.32
AKR1A1 P14550 1/20 0.32
AKR1B1 P15121 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL8129459 0.78 TDP1 (0.50) ALDH1A1POLBSMN1; SMN2LMNASLC6A9
SCHEMBL6200727 0.76 TSPO (0.41) ALDH1A1POLBSMN1; SMN2TSHRCA12
SCHEMBL6584974 0.75 APP (0.40) CA12CA1CA2CA9
SCHEMBL2442291 0.71 HSD17B10 (0.54) ALDH1A1POLBSMN1; SMN2LMNATSHR
SCHEMBL15389999 0.70 ALDH1A1 (0.39) ALDH1A1GAA
SCHEMBL7380176 0.70 POLB (0.62) POLBSMN1; SMN2LMNATSHRTDP1
SCHEMBL3209384 0.70 POLB (0.62) POLBSMN1; SMN2LMNATSHRTDP1
SCHEMBL12722183 0.70 MEN1 (0.57) ALDH1A1POLBSMN1; SMN2TSHRTDP1
SCHEMBL2442703 0.70 CA12 (0.38) ALDH1A1KEAP1NFE2L2SMN1; SMN2GAA
SCHEMBL2444264 0.69 POLB (0.45) POLBSMN1; SMN2LMNAHSD17B10

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-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-01-20 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-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments GLP1R, GIPR, GCGR ALDH1A1 1506/4885KEAP1 3907/4885NFE2L2 1106/4885

“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.