SCHEMBL5243293

SCHEMBL5243293

CC(C)(C)OC(=O)N1CC2COCC(C1)N2C(=O)OC(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.51
CHRM1 P11229 1/20 0.51
CHRM3 P20309 1/20 0.51
USP2 O75604 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NR1H2 P55055 1/20 0.47
RECQL P46063 1/20 0.44
PREP P48147 4/20 0.42
HSD11B1 P28845 1/20 0.40
HPGD P15428 1/20 0.40
KCNK3 O14649 1/20 0.39
KCNK9 Q9NPC2 1/20 0.39
EPHX1 P07099 1/20 0.38
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
NAMPT P43490 1/20 0.37

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
SCHEMBL5243300 0.90 USP2 (0.47) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL14706988 0.90 USP2 (0.50) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL31049077 0.87 USP2 (0.45) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL19413505 0.87 USP2 (0.47) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL11993192 0.86 CHRM2 (0.51) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL8305574 0.86 CHRM2 (0.64) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL30970603 0.85 NR1H2 (0.48) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL29536161 0.85 NR1H2 (0.44) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL21146017 0.84 USP2 (0.45) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL30915773 0.84 NR1H2 (0.60) CHRM2CHRM1CHRM3USP2SMN1; SMN2

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-20070196270-A1 Compounds As Ccri Antagonists HENG RICHARD 2007-08-23 US disclosed
US-20070196270-A1 Compounds As Ccri Antagonists HENG RICHARD 2007-08-23 US disclosed
EP-1794164-A2 BRIDGED PIPERAZINE AND PIPERIDINE DERIVATIVES AS CCR1 ANTAGONISTS Novartis AG (CH) 2007-06-13 EP disclosed
WO-2005103054-A2 BRIDGED PIPERAZINE AND PIPERIDINE DERIVATIVES AS CCRI ANTAGONISTS NOVARTIS AG (CH) 2005-11-03 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-20070196270-A1 Compounds As Ccri Antagonists CCR1, CCR10, CCR4 CHRM2 1644/4885CHRM1 1111/4885CHRM3 577/4885

“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.