SCHEMBL8538369

SCHEMBL8538369

COCC(=O)NCC(O)CNC(=O)COC

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
NPSR1 Q6W5P4 1/20 0.38
HPGD P15428 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
SPR P35270 1/20 0.37
LMNA P02545 3/20 0.36
ALDH1A1 P00352 2/20 0.36
RAB9A P51151 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPT P10636 2/20 0.34
CYP2C19 P33261 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALOX12 P18054 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL15834196 0.92 KISS1R (0.37) TSHRNPSR1HPGDSMN1; SMN2SPR
SCHEMBL15834098 0.92 KISS1R (0.37) TSHRNPSR1HPGDSMN1; SMN2SPR
SCHEMBL12732931 0.90 LMNA (0.45) TSHRNPSR1HPGDSMN1; SMN2SPR
SCHEMBL15833995 0.89 KDM4E (0.46) TSHRNPSR1HPGDSMN1; SMN2SPR
SCHEMBL15833979 0.88 LMNA (0.36) TSHRNPSR1HPGDSMN1; SMN2SPR
SCHEMBL15833983 0.86 CYP2D6 (0.38) TSHRNPSR1HPGDSMN1; SMN2SPR
SCHEMBL15833974 0.85 LMNA (0.40) TSHRNPSR1HPGDSMN1; SMN2SPR
SCHEMBL15833944 0.85 LMNA (0.40) TSHRNPSR1HPGDSMN1; SMN2SPR
SCHEMBL13744709 0.84 HPGD (0.41) TSHRNPSR1HPGDSMN1; SMN2SPR
SCHEMBL13744668 0.84 HPGD (0.41) TSHRNPSR1HPGDSMN1; SMN2SPR

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-8436183-B2 Synthetic multimerizing agents ARIAD PHARMACEUTICALS, INC. (US) 2013-05-07 US disclosed
US-20120130076-A1 Synthetic Multimerizing Agents ARIAD PHARMACEUTICALS, INC. (US) 2012-05-24 US disclosed
US-8106191-B2 Compounds based on N- acyl-pipecolyl and N-acyl-prolyl ligand moieties for multimerizing chimeric proteins containing immunophilin-derived domains ARIAD PHARMACEUTICALS, INC. (US) 2012-01-31 US disclosed
US-8106191-B2 Compounds based on N- acyl-pipecolyl and N-acyl-prolyl ligand moieties for multimerizing chimeric proteins containing immunophilin-derived domains ARIAD PHARMACEUTICALS, INC. (US) 2012-01-31 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-20120130076-A1 Synthetic Multimerizing Agents FKBP1B, FKBP2, FKBP14 TSHR 3868/4885NPSR1 1171/4885HPGD 3763/4885

“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.