SCHEMBL5633658

SCHEMBL5633658

CCCCN1C(=O)C(=C2SCCCS2)C(=O)N(C2CCC(c3ccccc3)C2)C1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.35
OPRD1 P41143 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
GRM2 Q14416 3/20 0.33
MAPK1 P28482 3/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
HTT P42858 2/20 0.33
DRD2 P14416 2/20 0.32
DRD1 P21728 1/20 0.32
DRD4 P21917 1/20 0.32
DRD5 P21918 1/20 0.32
DRD3 P35462 1/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
NPC1 O15118 2/20 0.32

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
SCHEMBL5634473 0.82 L3MBTL1 (0.38) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL5633146 0.81 ALDH1A1 (0.34) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL5632994 0.80 ALDH1A1 (0.36) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL5633286 0.78 OPRM1 (0.41) OPRM1OPRD1L3MBTL1SMN1; SMN2GRM2
SCHEMBL5633492 0.75 L3MBTL1 (0.43) L3MBTL1SMN1; SMN2LMNAHTTMEN1
SCHEMBL5634261 0.75 ALDH1A1 (0.38) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL5632662 0.74 L3MBTL1 (0.48) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL30942732 0.74 FKBP1A (0.34) L3MBTL1MAPK1ALDH1A1DRD1DRD4
SCHEMBL5634864 0.73 TDP1 (0.50) L3MBTL1SMN1; SMN2MAPK1ALDH1A1LMNA
SCHEMBL30943049 0.72 CCR5 (0.40) L3MBTL1SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070123548-A1 Pth agonists COWAN DAVID J 2007-05-31 US disclosed
EP-1713782-A1 PTH AGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2006-10-25 EP disclosed
WO-2005077918-A1 PTH AGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2005-08-25 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-20070123548-A1 Pth agonists PTH1R, SSTR3, CALCR OPRM1 757/4885OPRD1 470/4885L3MBTL1 4667/4885

“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.