SCHEMBL1044181

SCHEMBL1044181

CCOC(=O)Cc1ccc(C(=N)N)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F2 P00734 9/20 0.59
F10 P00742 8/20 0.59
PRSS1 P07477 4/20 0.56
PRSS2 P07478 3/20 0.56
PRSS3 P35030 3/20 0.56
PLG P00747 1/20 0.56
C1S P09871 1/20 0.56
LMNA P02545 2/20 0.51
MAPT P10636 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CYP4Z1 Q86W10 1/20 0.49
LOXL2 Q9Y4K0 1/20 0.47

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
SCHEMBL5009885 0.86 LMNA (0.54) F2F10LMNAMAPTSMN1; SMN2
SCHEMBL68851 0.84 CYP4Z1 (0.62) LMNAMAPTSMN1; SMN2CYP4Z1
Hydrochloric Acid SCHEMBL7301701 0.83 F2 (0.62) F2F10PRSS1PRSS2PRSS3
SCHEMBL6393097 0.81 ALDH1A1 (0.57) LMNAMAPTSMN1; SMN2CYP4Z1
SCHEMBL393094 0.81 LMNA (0.55) LMNAMAPTSMN1; SMN2CYP4Z1
SCHEMBL2170299 0.81 CA12 (0.61) LMNAMAPTSMN1; SMN2CYP4Z1
SCHEMBL13262912 0.81 L3MBTL1 (0.50) LMNAMAPTSMN1; SMN2CYP4Z1
SCHEMBL3087853 0.81 CYP4Z1 (0.54) F2F10LMNAMAPTSMN1; SMN2
SCHEMBL15955709 0.79 KMT2A (0.60) LMNAMAPTSMN1; SMN2CYP4Z1
SCHEMBL1687054 0.79 LMNA (0.54) LMNAMAPTSMN1; SMN2CYP4Z1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010130708-A9 BETA-LACTAMASE INHIBITORS NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2011-01-13 WO disclosed
WO-2010130708-A1 BETA-LACTAMASE INHIBITORS NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2010-11-18 WO disclosed
US-20100292185-A1 BETA-LACTAMASE INHIBITORS NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD (BM) 2010-11-18 US disclosed
US-7119094-B1 Substituted polycyclic aryl and heteroarpyl pyrazinones useful for selective inhibition of the coagulation cascade WARNER-LAMBERT COMPANY (US) 2006-10-10 US disclosed
US-20050043313-A1 Substituted polycyclic aryl and heteroaryl pyrazinones useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2005-02-24 US disclosed
US-6664255-B1 1-alkylamido-3-amino substituted; inhibiting serine proteases PHARMACIA CORPORATION 2003-12-16 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-20050043313-A1 Substituted polycyclic aryl and heteroaryl pyrazinones useful for selective inhibition of the coagulation cascade TFPI, TFPI2, PLAT F2 6/4885F10 48/4885PRSS1 8/4885
US-20100292185-A1 BETA-LACTAMASE INHIBITORS GANAB, BPGM, BLVRB F2 2849/4885F10 3318/4885PRSS1 1459/4885

“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.