SCHEMBL2183137

SCHEMBL2183137

C[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H]([C]=O)Cc1c[nH]c2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSC P53634 5/20 0.61
KDM4E B2RXH2 2/20 0.56
MAPT P10636 2/20 0.56
MEN1 O00255 1/20 0.56
LMNA P02545 1/20 0.56
MPO P05164 1/20 0.56
TSHR P16473 1/20 0.56
BLM P54132 1/20 0.56
PMP22 Q01453 1/20 0.56
KMT2A Q03164 1/20 0.56
HIF1A Q16665 1/20 0.56
OPRM1 P35372 2/20 0.54
OPRD1 P41143 2/20 0.54
ADRB1 P08588 1/20 0.51
HTR1A P08908 1/20 0.51
ADRA2A P08913 1/20 0.51
SLC6A2 P23975 1/20 0.51
HTR1D P28221 1/20 0.51
HTR1B P28222 1/20 0.51
HTR2A P28223 1/20 0.51

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
SCHEMBL27871540 0.93 CTSC (0.64) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL2182587 0.92 CTSC (0.62) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL5557252 0.89 CTSC (0.61) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL10750299 0.89 CTSC (0.54) CTSCOPRM1OPRD1ACEECE1
SCHEMBL2194704 0.89 IL1RN (0.55) CTSCECE1
SCHEMBL9189384 0.89 CTSC (0.58) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL8397046 0.88 KDM4E (0.60) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL2192888 0.88 KDM4E (0.60) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL8397051 0.88 KDM4E (0.60) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL6906379 0.88 CTSC (0.62) CTSCKDM4EMAPTMEN1LMNA

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-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 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-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP CTSC 331/4885KDM4E 4758/4885MAPT 405/4885

“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.