SCHEMBL4089937

SCHEMBL4089937

C[C@@H]1CN(C(=O)OCCN2CCN(C(=O)OC(C)(C)C)CC2)C[C@H](C)O1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CHRM2 P08172 2/20 0.40
CHRM1 P11229 2/20 0.40
CHRM4 P08173 1/20 0.40
CHRM3 P20309 1/20 0.40
NR1H2 P55055 1/20 0.40
RECQL P46063 1/20 0.38
EPHX2 P34913 4/20 0.38
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
HPGD P15428 1/20 0.36
ACKR3 P25106 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL13723257 0.84 ALDH1A1 (0.40) SMN1; SMN2HPGDALDH1A1
SCHEMBL6407001 0.82 GPR119 (0.47) NR1H2RECQL
SCHEMBL6407004 0.82 GPR119 (0.47) NR1H2RECQL
SCHEMBL72535 0.81 NR1H2 (0.51) USP2SMN1; SMN2NR1H2RECQLDDB1
SCHEMBL13812216 0.81 CHRM2 (0.54) USP2SMN1; SMN2CHRM2CHRM1CHRM4
SCHEMBL4093465 0.79 MEN1 (0.38) SMN1; SMN2HPGDALDH1A1
SCHEMBL4093461 0.79 MEN1 (0.38) SMN1; SMN2HPGDALDH1A1
SCHEMBL13724256 0.79 HRH1 (0.34) SMN1; SMN2HPGDALDH1A1
SCHEMBL11344621 0.77 USP2 (0.45) USP2SMN1; SMN2CHRM2CHRM1CHRM4
SCHEMBL8242595 0.76 USP2 (0.61) USP2SMN1; SMN2CHRM2CHRM1CHRM4

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-20090203695-A1 Compounds IV BIOVITRUM AB (SE) 2009-08-13 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-20090203695-A1 Compounds IV GPR119, FABP4, LIPC USP2 4000/4885SMN1; SMN2 4479/4885CHRM2 888/4885

“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.