SCHEMBL975450

SCHEMBL975450

CCOC(=O)c1cn2ccc(NC(=O)c3cc4cc(F)ccc4n3Cc3cccc(F)c3)cc2n1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
POLB P06746 1/20 0.46
F10 P00742 4/20 0.45
ECE1 P42892 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
PTGDR2 Q9Y5Y4 3/20 0.40
MAPT P10636 3/20 0.40
TP53 P04637 1/20 0.40
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.40
MAOB P27338 1/20 0.39
ABCB1 P08183 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HTT P42858 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
SCHEMBL974068 0.93 KDM4E (0.42) KDM4EPOLBF10ECE1SMN1; SMN2
SCHEMBL976086 0.91 F10 (0.47) KDM4EPOLBF10ECE1SMN1; SMN2
SCHEMBL977067 0.88 ECE1 (0.46) F10ECE1PTGDR2MAOBABCB1
SCHEMBL975637 0.84 F10 (0.43) F10ECE1SMN1; SMN2PTGDR2MAPT
SCHEMBL975282 0.84 F10 (0.46) KDM4EF10ECE1PTGDR2MAPT
SCHEMBL974077 0.84 KDM4E (0.41) KDM4EPOLBSMN1; SMN2MAPTLMNA
SCHEMBL973562 0.84 ECE1 (0.46) F10ECE1MAPTMAOBABCB1
SCHEMBL974750 0.83 KDM4E (0.51) KDM4EF10MAPTLMNAGLA
SCHEMBL975576 0.80 ECE1 (0.47) F10ECE1PTGDR2MAOBABCB1
SCHEMBL974169 0.80 SMN1; SMN2 (0.41) KDM4EF10ECE1SMN1; SMN2MAPT

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
EP-2235016-B1 AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2013-09-18 EP disclosed
US-8394820-B2 N-azabicyclic carboxamide derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-03-12 US disclosed
US-20110009444-A1 N-AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-01-13 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-20110009444-A1 N-AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF XDH, NQO2, SLC28A2 KDM4E 246/4885POLB 960/4885F10 2006/4885

“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.