SCHEMBL4900428

SCHEMBL4900428

Cc1ccc(-n2ncc(N3CCN(C(=O)OC(C)(C)C)CC3)c(Cl)c2=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DCTPP1 Q9H773 4/20 0.62
NPBWR1 P48145 1/20 0.62
MCHR1 Q99705 1/20 0.62
ALDH1A1 P00352 8/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
RXFP1 Q9HBX9 1/20 0.52
MAPT P10636 3/20 0.50
LMNA P02545 1/20 0.50
GPR119 Q8TDV5 1/20 0.50
RAB9A P51151 1/20 0.48
TP53 P04637 1/20 0.48

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
SCHEMBL14221005 0.93 DCTPP1 (0.64) DCTPP1NPBWR1MCHR1ALDH1A1SMN1; SMN2
SCHEMBL4672310 0.85 DCTPP1 (0.62) DCTPP1ALDH1A1SMN1; SMN2RXFP1MAPT
SCHEMBL11945601 0.85 ALDH1A1 (0.64) DCTPP1ALDH1A1SMN1; SMN2RXFP1MAPT
SCHEMBL14494838 0.82 DCTPP1 (0.61) DCTPP1ALDH1A1SMN1; SMN2RXFP1MAPT
SCHEMBL14282399 0.80 NPBWR1 (0.54) DCTPP1NPBWR1MCHR1ALDH1A1SMN1; SMN2
SCHEMBL4930954 0.80 NPBWR1 (0.55) NPBWR1MCHR1MAPTGPR119TP53
SCHEMBL14282396 0.79 NPBWR1 (0.54) NPBWR1MCHR1ALDH1A1MAPTLMNA
SCHEMBL4902525 0.79 NPBWR1 (0.54) NPBWR1MCHR1MAPTGPR119TP53
SCHEMBL11953500 0.78 SMN1; SMN2 (0.52) DCTPP1NPBWR1MCHR1ALDH1A1SMN1; SMN2
SCHEMBL14220819 0.78 NPBWR1 (0.52) DCTPP1NPBWR1MCHR1MAPTGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080292547-A1 Novel Imaging Agents for Fibrosis TOLLESHAUG HELGE 2008-11-27 US disclosed
US-20080292547-A1 Novel Imaging Agents for Fibrosis TOLLESHAUG HELGE 2008-11-27 US disclosed
US-20080292547-A1 Novel Imaging Agents for Fibrosis TOLLESHAUG HELGE 2008-11-27 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-20080292547-A1 Novel Imaging Agents for Fibrosis LOXL1, LOXL2, LOXL3 DCTPP1 4220/4885NPBWR1 733/4885MCHR1 1304/4885

“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.