SCHEMBL3073675

SCHEMBL3073675

CCN(CC)CCc1cc(NC(=O)c2cccnc2)ccc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.56
▸ NPSR1 Q6W5P4 2/20 0.56
▸ GFER P55789 1/20 0.56
▸ RAB9A P51151 7/20 0.52
▸ NPC1 O15118 5/20 0.52
▸ SMN1; SMN2 Q16637 4/20 0.52
▸ KCNK3 O14649 1/20 0.51
▸ ALDH1A1 P00352 4/20 0.49
▸ HTT P42858 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ TP53 P04637 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ LMNA P02545 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL7339505 0.87 RAB9A (0.64) MAPTNPSR1GFERRAB9ANPC1
SCHEMBL5582805 0.82 MCHR1 (0.64) MAPTSMN1; SMN2MEN1KMT2ATDP1
SCHEMBL5925633 0.76 TERT (0.37) SMN1; SMN2ALDH1A1GAAL3MBTL1
SCHEMBL20335185 0.75 ALDH1A1 (0.37) SMN1; SMN2ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL13683778 0.74 NPSR1 (0.63) MAPTNPSR1GFERRAB9ANPC1
SCHEMBL6610208 0.73 MCHR1 (0.63) MAPTNPSR1GFERRAB9ASMN1; SMN2
SCHEMBL3079077 0.73 MAPT (0.62) MAPTNPSR1GFERRAB9ANPC1
SCHEMBL10940026 0.73 KCNK3 (0.81) RAB9ANPC1SMN1; SMN2KCNK3ALDH1A1
SCHEMBL2498414 0.73 RAB9A (0.76) RAB9ANPC1SMN1; SMN2KCNK3ALDH1A1
SCHEMBL7321703 0.72 GAA (0.57) RAB9ASMN1; SMN2KCNK3ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100227896-A1 USE OF VITAMIN PP COMPOUNDS ASTELLAS DEUTSCHLAND GMBH (DE) 2010-09-09 — — US disclosed
EP-1079832-B1 USE OF VITAMIN PP COMPOUNDS KLINGE CO CHEM PHARM FAB (DE) 2005-11-30 — — EP disclosed
EP-1079832-A1 USE OF VITAMIN PP COMPOUNDS Klinge Pharma GmbH (DE) 2001-03-07 — — EP disclosed
WO-1999053920-A1 USE OF VITAMIN PP COMPOUNDS KLINGE PHARMA GMBH (DE) 1999-10-28 — — WO 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-20100227896-A1 USE OF VITAMIN PP COMPOUNDS PNPO, NAMPT, NAPRT MAPT 2497/4885NPSR1 2343/4885GFER 1982/4885

“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.

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