SCHEMBL6312656

SCHEMBL6312656

O=C(O)CCNC(=O)c1c[c]ccc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT5 Q9NXA8 2/20 0.46
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
GCG P01275 3/20 0.38
MAPK1 P28482 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GCGR P47871 2/20 0.36
NME4 O00746 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
CHRM1 P11229 1/20 0.36
ADORA2A P29274 1/20 0.36
AVPR2 P30518 1/20 0.36
AGTR1 P30556 1/20 0.36
SLC6A4 P31645 1/20 0.36

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
SCHEMBL6320179 0.82 NPC1 (0.43) NPC1RAB9ALMNAL3MBTL1NPSR1
SCHEMBL6312283 0.81 CA1 (0.41) SIRT5LMNAL3MBTL1NPSR1CA1
SCHEMBL6625604 0.80 LMNA (0.38) NPC1RAB9ALMNAL3MBTL1CA2
SCHEMBL6321645 0.79 TSHR (0.43) NPC1RAB9ALMNAL3MBTL1NPSR1
SCHEMBL6319508 0.79 NPC1 (0.43) NPC1RAB9ALMNAL3MBTL1NPSR1
SCHEMBL6316170 0.78 NPSR1 (0.42) LMNAL3MBTL1NPSR1CA1CA2
SCHEMBL6320988 0.78 KMT2A (0.48) NPC1RAB9AL3MBTL1NPSR1MAPK1
SCHEMBL1476023 0.74 GAA (0.56) NPC1ALDH1A1SMN1; SMN2TDP1
SCHEMBL4523453 0.74 CA1 (0.57) SIRT5NPC1RAB9ALMNAL3MBTL1
SCHEMBL6318775 0.73 NPSR1 (0.45) SIRT5NPC1RAB9ALMNAL3MBTL1

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 SIRT5 689/4885NPC1 2833/4885RAB9A 4571/4885

“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.