SCHEMBL17812997

SCHEMBL17812997

COCCC(=O)NCCNC(=O)CCN1C(=O)CC(SN2CCC[C@H]2C=O)C1=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ DRD2 P14416 1/20 0.35
▸ ADRA1A P35348 1/20 0.34
▸ HRH1 P35367 1/20 0.34
▸ ADRA1B P35368 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ TSHR P16473 2/20 0.33
▸ CYP2C19 P33261 1/20 0.32
▸ GAA P10253 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ TP53 P04637 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
SCHEMBL17812993 0.95 SMN1; SMN2 (0.41) SMN1; SMN2HPGDHTTDRD2ADRA1A
SCHEMBL19372679 0.93 DRD2 (0.32) SMN1; SMN2HPGDHTTDRD2ADRA1A
SCHEMBL18724456 0.91 ALDH1A1 (0.31) DRD2CYP2C19GAAPOLB
SCHEMBL17812995 0.84 GAA (0.34) GAA
SCHEMBL17812985 0.81 — —
SCHEMBL17812994 0.81 ALDH1A1 (0.32) —
SCHEMBL17812998 0.81 FOLH1 (0.33) —
SCHEMBL19372840 0.80 SMN1; SMN2 (0.37) SMN1; SMN2HPGDHTTADRA1AHRH1
SCHEMBL10148003 0.80 SMN1; SMN2 (0.44) SMN1; SMN2HPGDHTTTSHRCYP2C19
SCHEMBL14980037 0.79 SMN1; SMN2 (0.44) SMN1; SMN2HPGDHTTTSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9763995-B2 Polymer conjugates of protegrin peptides NEKTAR THERAPEUTICS (US) 2017-09-19 — — US disclosed
US-20160158311-A1 POLYMER CONJUGATES OF PROTEGRIN PEPTIDES NEKTAR THERAPEUTICS 2016-06-09 — — 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-20160158311-A1 POLYMER CONJUGATES OF PROTEGRIN PEPTIDES PSMG3, PSMB11, UBQLN1 SMN1; SMN2 1248/4885HPGD 2242/4885HTT 116/4885

“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.

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