SCHEMBL5605774

SCHEMBL5605774

CN1CCN(C(=O)C2CCC2C(=O)O)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPP5C P53041 2/20 0.53
▸ PPP2CA P67775 1/20 0.53
▸ TFPI2 P48307 1/20 0.53
▸ NPY4R P50391 1/20 0.53
▸ HTT P42858 1/20 0.50
▸ CTSB P07858 1/20 0.49
▸ CTSS P25774 1/20 0.49
▸ CTSK P43235 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ CYP1A2 P05177 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ HSD11B1 P28845 2/20 0.42
▸ ADAM10 O14672 1/20 0.41
▸ ERBB2 P04626 1/20 0.41
▸ MMP2 P08253 1/20 0.41
▸ MMP9 P14780 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ EPHX2 P34913 1/20 0.39
▸ TSHR P16473 1/20 0.38

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
SCHEMBL5605778 0.92 CTSB (0.57) PPP5CPPP2CATFPI2NPY4RHTT
SCHEMBL31207070 0.92 CTSB (0.57) PPP5CPPP2CATFPI2NPY4RHTT
SCHEMBL16424491 0.81 HPGD (0.52) TFPI2CTSBCTSSCTSKHSD11B1
SCHEMBL31207269 0.79 ALDH1A1 (0.53) PPP5CPPP2CATFPI2NPY4RHTT
SCHEMBL16838112 0.79 CHRNB2 (0.52) HTTCTSBCTSSCTSKLMNA
SCHEMBL1163992 0.79 HPGD (0.56) TFPI2HTTCTSBCTSSCTSK
SCHEMBL1163991 0.79 HPGD (0.56) TFPI2HTTCTSBCTSSCTSK
SCHEMBL16424010 0.76 ALDH1A1 (0.45) HTTLMNAADAM10ERBB2MMP2
SCHEMBL2075903 0.74 HTT (0.81) PPP5CPPP2CATFPI2NPY4RHTT
SCHEMBL699775 0.73 HPGD (0.54) TFPI2CTSBCTSSCTSKHSD11B1

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-7166594-B2 Antibacterial activity AVENTIS PHARMA S.A. (FR) 2007-01-23 — — US disclosed
US-20030149004-A1 Streptogramin derivatives, their preparation and compositions containing them AVENTIS PHARMA S.A. 2003-08-07 — — US disclosed
US-6569854-B1 Virginamycins AVENTIS PHARMA S.A. (FR) 2003-05-27 — — 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-20030149004-A1 Streptogramin derivatives, their preparation and compositions containing them MRPL21, ABHD5, APEH PPP5C 4256/4885PPP2CA 1985/4885TFPI2 2621/4885

“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.

Send feedback