SCHEMBL3453154

SCHEMBL3453154

Cc1ccc2c(=O)oc(Nc3ccc(C#N)cc3)nc2c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
C1R P00736 5/20 0.56
ELANE P08246 3/20 0.49
CSNK1D P48730 2/20 0.47
CSNK1G2 P78368 2/20 0.47
KDM4E B2RXH2 4/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
HPGD P15428 1/20 0.47
MAPT P10636 1/20 0.47
CSNK1A1 P48729 1/20 0.46
GSK3B P49841 1/20 0.46
ROCK1 Q13464 1/20 0.46
GRM2 Q14416 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
MAPKAPK2 P49137 1/20 0.41

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
SCHEMBL3452627 0.87 C1R (0.56) C1RELANEKDM4ENPC1RAB9A
SCHEMBL3453634 0.83 ELANE (0.71) C1RELANEKDM4ENPC1RAB9A
SCHEMBL3453320 0.82 ELANE (0.74) C1RELANEKDM4ENPC1RAB9A
SCHEMBL3452122 0.79 C1R (0.63) C1RELANEKDM4ENPC1RAB9A
SCHEMBL3453817 0.79 C1R (0.69) C1RKDM4ENPC1RAB9AALDH1A1
SCHEMBL3452830 0.78 C1R (0.58) C1RELANEKDM4ENPC1RAB9A
SCHEMBL15641096 0.78 ELANE (0.60) C1RELANEKDM4ENPC1RAB9A
SCHEMBL4266471 0.77 KDM4E (0.44) ELANECSNK1DCSNK1G2KDM4ENPC1
SCHEMBL3453528 0.76 ELANE (0.63) C1RELANECSNK1DCSNK1G2KDM4E
SCHEMBL3452727 0.76 C1R (0.51) C1RELANEKDM4ENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144395-B1 2-AMINO-BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF OBESITY ALIZYME THERAPEUTICS LTD (GB) 2005-04-20 EP claimed
US-6656934-B2 Enzyme inhibitor ALIZYME THERAPEUTICS LIMITED (GB) 2003-12-02 US claimed
US-20030191123-A1 2-amino-benzoxazinone derivatives for the treatment of obesity NORGINE B.V. (NL) 2003-10-09 US claimed
US-20030013707-A1 2-amino-benzoxazinone derivatives for the treatment of obesity NORGINE B.V. (NL) 2003-01-16 US claimed
US-7776853-B2 2-amino-benzoxazinone derivatives for the treatment of obesity NORGINE B.V. (NL) 2010-08-17 US disclosed
US-7776853-B2 2-amino-benzoxazinone derivatives for the treatment of obesity NORGINE B.V. (NL) 2010-08-17 US disclosed
US-7776853-B2 2-amino-benzoxazinone derivatives for the treatment of obesity NORGINE B.V. (NL) 2010-08-17 US disclosed
US-6656934-B2 Enzyme inhibitor ALIZYME THERAPEUTICS LIMITED (GB) 2003-12-02 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 (2 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-20030191123-A1 2-amino-benzoxazinone derivatives for the treatment of obesity CYP4X1, CYP2B6, BBOX1 C1R 3778/4885ELANE 730/4885CSNK1D 895/4885
US-20030013707-A1 2-amino-benzoxazinone derivatives for the treatment of obesity CYP4X1, CYP2B6, BBOX1 C1R 3778/4885ELANE 730/4885CSNK1D 895/4885

“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.