SCHEMBL4471485

SCHEMBL4471485

CC(=O)C1COCCN1C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA9 Q16790 3/20 0.39
CNR2 P34972 2/20 0.39
CA2 P00918 2/20 0.39
MMP1 P03956 2/20 0.32
MMP3 P08254 2/20 0.32
MMP8 P22894 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
MMP13 P45452 1/20 0.31
FKBP1A P62942 1/20 0.31
GLA P06280 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL14569608 1.00 SMN1; SMN2 (0.39) SMN1; SMN2CA12CA1CA9CNR2
SCHEMBL4471494 1.00 SMN1; SMN2 (0.39) SMN1; SMN2CA12CA1CA9CNR2
SCHEMBL27797009 0.85 CA12 (0.40) SMN1; SMN2CA12CA1CA9CNR2
SCHEMBL978536 0.83 CNR2 (0.41) SMN1; SMN2CA12CA1CA9CNR2
SCHEMBL18612 0.83 CNR2 (0.41) SMN1; SMN2CA12CA1CA9CNR2
SCHEMBL3138562 0.83 CNR2 (0.41) SMN1; SMN2CA12CA1CA9CNR2
SCHEMBL23371781 0.82 SMN1; SMN2 (0.42) SMN1; SMN2CA12CA1CA9CNR2
SCHEMBL16160600 0.82 CNR2 (0.38) SMN1; SMN2CA12CA1CA9CNR2
Hydrochloric Acid SCHEMBL186334 0.82 CNR2 (0.40) SMN1; SMN2CA12CA1CA9CNR2
SCHEMBL16160604 0.82 CNR2 (0.38) SMN1; SMN2CA12CA1CA9CNR2

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-7550486-B2 N-ureidoalkyl-piperidines as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2009-06-23 US disclosed
US-20080132523-A1 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2008-06-05 US disclosed
US-7351720-B2 N-ureidoalkyl-piperidines as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2008-04-01 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-20080132523-A1 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ACKR3, CCR7, CCR2 SMN1; SMN2 4441/4885CA12 4725/4885CA1 3136/4885

“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.