SCHEMBL13209752

SCHEMBL13209752

CC(=O)c1noc2c(F)cccc12

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 9/20 0.43
SMN1; SMN2 Q16637 3/20 0.39
TP53 P04637 1/20 0.39
HIF1A Q16665 2/20 0.38
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL15237484 0.83 SSTR4 (0.38) SSTR4SMN1; SMN2TP53HIF1A
SCHEMBL24174035 0.83 SSTR4 (0.43) SSTR4SMN1; SMN2TP53HIF1ANPC1
SCHEMBL24663489 0.81 SMN1; SMN2 (0.56) SSTR4SMN1; SMN2TP53HIF1AL3MBTL1
SCHEMBL13209721 0.79 HTT (0.47) L3MBTL1
SCHEMBL13209751 0.78 SSTR4 (0.38) SSTR4SMN1; SMN2TP53
SCHEMBL2442815 0.73 KDM4C (0.42) SSTR4SMN1; SMN2TP53HIF1ANPC1
SCHEMBL5511858 0.73 SSTR4 (0.39) SSTR4SMN1; SMN2TP53CES2CES1
SCHEMBL13576849 0.73 GRM4 (0.42) SSTR4SMN1; SMN2TP53NPC1RAB9A
SCHEMBL19570353 0.72 SSTR4 (0.65) SSTR4
SCHEMBL3434886 0.72 HIF1A (0.61) HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9040706-B2 Pyrrolidine inhibitors of IAP GENENTECH, INC. (US) 2015-05-26 US disclosed
US-9040706-B2 Pyrrolidine inhibitors of IAP GENENTECH, INC. (US) 2015-05-26 US disclosed
US-20140080805-A1 PYRROLIDINE INHIBITORS OF IAP GENENTECH, INC. (US) 2014-03-20 US disclosed
US-20140080805-A1 PYRROLIDINE INHIBITORS OF IAP GENENTECH, INC. (US) 2014-03-20 US disclosed
EP-1836201-B1 PYRROLIDINE INHIBITORS OF IAP GENENTECH INC (US) 2010-08-11 EP disclosed
US-20090318409-A1 PYRROLIDINE INHIBITORS OF IAP GENENTECH, INC. (US) 2009-12-24 US disclosed
US-20090318409-A1 PYRROLIDINE INHIBITORS OF IAP GENENTECH, INC. (US) 2009-12-24 US disclosed
US-20090176822-A1 PYRROLIDINE INHIBITORS OF IAP GENENTECH, INC. (US) 2009-07-09 US disclosed
US-20090176822-A1 PYRROLIDINE INHIBITORS OF IAP GENENTECH, INC. (US) 2009-07-09 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 (3 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-20090176822-A1 PYRROLIDINE INHIBITORS OF IAP BIRC5, XIAP, BIRC2 SSTR4 4060/4885SMN1; SMN2 2913/4885TP53 27/4885
US-20140080805-A1 PYRROLIDINE INHIBITORS OF IAP BIRC5, XIAP, BIRC2 SSTR4 4060/4885SMN1; SMN2 2913/4885TP53 27/4885
US-20090318409-A1 PYRROLIDINE INHIBITORS OF IAP BIRC5, XIAP, BIRC2 SSTR4 4060/4885SMN1; SMN2 2913/4885TP53 27/4885

“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.