SCHEMBL4914263

SCHEMBL4914263

COc1ccc(CNC(=O)c2ccc(CNC(=O)CCC3CCN(Cc4ccc(Cl)cc4)CC3)cc2)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
ALDH1A1 P00352 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
GAA P10253 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
POLB P06746 2/20 0.51
CCR2 P41597 1/20 0.51
BCHE P06276 1/20 0.50
ACHE P22303 1/20 0.50
TP53 P04637 1/20 0.49
ACKR3 P25106 1/20 0.49

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
SCHEMBL4924133 0.92 ALDH1A1 (0.61) LMNASMN1; SMN2ALDH1A1GAAMEN1
SCHEMBL4924933 0.90 SMN1; SMN2 (0.53) LMNASMN1; SMN2ALDH1A1GAAMEN1
SCHEMBL4922323 0.87 SMN1; SMN2 (0.54) LMNASMN1; SMN2ALDH1A1GAAMEN1
SCHEMBL4917794 0.84 LMNA (0.52) LMNASMN1; SMN2ALDH1A1L3MBTL1GAA
SCHEMBL14586598 0.84 LMNA (0.55) LMNASMN1; SMN2ALDH1A1L3MBTL1GAA
Hydrochloric Acid SCHEMBL5577422 0.83 LMNA (0.54) LMNASMN1; SMN2ALDH1A1L3MBTL1GAA
SCHEMBL4920736 0.82 LMNA (0.52) LMNASMN1; SMN2ALDH1A1L3MBTL1GAA
SCHEMBL4914266 0.82 LMNA (0.54) LMNASMN1; SMN2ALDH1A1L3MBTL1GAA
SCHEMBL4916472 0.81 TSHR (0.60) SMN1; SMN2MEN1KMT2APOLB
SCHEMBL5577315 0.81 GAA (0.57) LMNASMN1; SMN2ALDH1A1L3MBTL1GAA

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-20080081824-A1 Substituted piperidines as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY 2008-04-03 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-20080081824-A1 Substituted piperidines as modulators of chemokine receptor activity CCR1, CCR3, CCR2 LMNA 2533/4885SMN1; SMN2 3688/4885ALDH1A1 1255/4885

“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.