SCHEMBL6312283

SCHEMBL6312283

NC(=O)c1cc[c]cc1C(=O)NCCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPK1 P28482 1/20 0.36
ITGB3 P05106 3/20 0.35
ITGA2B P08514 3/20 0.35
SIRT5 Q9NXA8 2/20 0.35
NME4 O00746 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CHRM1 P11229 1/20 0.35
ADORA2A P29274 1/20 0.35
AVPR2 P30518 1/20 0.35
AGTR1 P30556 1/20 0.35
SLC6A4 P31645 1/20 0.35
AVPR1A P37288 1/20 0.35
HTR3A P46098 1/20 0.35
GCDH Q92947 1/20 0.35
SLC29A1 Q99808 1/20 0.35

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
SCHEMBL6319508 0.81 NPC1 (0.43) CA1CA2LMNAL3MBTL1NPSR1
SCHEMBL6321645 0.81 TSHR (0.43) CA1CA2LMNAL3MBTL1NPSR1
SCHEMBL6312656 0.81 SIRT5 (0.46) CA1CA2LMNAL3MBTL1NPSR1
SCHEMBL6320179 0.81 NPC1 (0.43) CA1CA2LMNAL3MBTL1NPSR1
SCHEMBL6316170 0.77 NPSR1 (0.42) CA1CA2LMNAL3MBTL1NPSR1
SCHEMBL6320988 0.77 KMT2A (0.48) L3MBTL1NPSR1MAPK1
SCHEMBL12970754 0.75 ALDH1A1 (0.38) CA1CA2L3MBTL1MAPK1TDP1
SCHEMBL4523453 0.73 CA1 (0.57) CA1CA2LMNAL3MBTL1MAPK1
SCHEMBL4955428 0.67 ALDH1A1 (0.59) CA1CA2LMNANPSR1MAPK1
SCHEMBL6903284 0.67 TSHR (0.58) LMNA

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 CA1 4589/4885CA2 1695/4885LMNA 2720/4885

“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.