SCHEMBL2707702

SCHEMBL2707702

CCCNC(=O)N1CC(O)C2NCCC21

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
PRCP P42785 2/20 0.35
SPHK1 Q9NYA1 4/20 0.35
EPHX1 P07099 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP2C19 P33261 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KMT2A Q03164 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 1/20 0.31
DPP4 P27487 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
SCHEMBL9611388 0.78 CYP1A2 (0.34) SMN1; SMN2
SCHEMBL8511474 0.78 CYP1A2 (0.34) SMN1; SMN2
SCHEMBL4215633 0.69 CHRM2 (0.42) CYP2C19
SCHEMBL4050279 0.69 CHRM2 (0.42) CYP2C19
SCHEMBL4191884 0.69 CHRM2 (0.42) CYP2C19
SCHEMBL13944478 0.69 CHRM2 (0.42) CYP2C19
SCHEMBL3947334 0.66 CYP19A1 (0.32)
SCHEMBL4215709 0.65 PIK3CD (0.45) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL4212708 0.65 PIK3CD (0.45) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL8514994 0.65 DPP4 (0.44) LMNADPP4

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-8415486-B2 IAP inhibitors TETRALOGIC PHARMACEUTICALS CORP. (US) 2013-04-09 US disclosed
US-20120135990-A1 IAP INHIBITORS TETRALOGIC PHARMACEUTICALS CORP. (US) 2012-05-31 US disclosed
EP-2434890-A1 IAP INHIBITORS Tetralogic Pharmaceuticals Corp. (US) 2012-04-04 EP disclosed
WO-2010138666-A1 IAP INHIBITORS TETRALOGIC PHARMACEUTICALS CORP. (US) 2010-12-02 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-20120135990-A1 IAP INHIBITORS XIAP, IAPP, BIRC5 LMNA 767/4885PRCP 182/4885SPHK1 3714/4885

“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.