SCHEMBL4428107

SCHEMBL4428107

O=C1NC(=O)C(=Cc2ccc(C=C3C(=O)NC(=O)NC3=O)cc2)C(=O)N1

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 7/20 0.80
CA12 O43570 1/20 0.69
CA1 P00915 1/20 0.69
CA2 P00918 1/20 0.69
CA7 P43166 1/20 0.69
CA9 Q16790 1/20 0.69
MAPT P10636 5/20 0.63
ALDH1A1 P00352 4/20 0.63
KDM4E B2RXH2 3/20 0.63
GAA P10253 1/20 0.63
POLB P06746 2/20 0.62
KMT2A Q03164 2/20 0.58
L3MBTL1 Q9Y468 1/20 0.57
PPARG P37231 1/20 0.57

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
SCHEMBL14033557 0.93 METAP1 (0.71) METAP1CA12CA1CA2CA7
SCHEMBL31406586 0.89 GSK3B (0.70) METAP1CA12CA1CA2CA7
SCHEMBL16543019 0.89 METAP1 (1.00) METAP1CA12CA1CA2CA7
SCHEMBL28680183 0.89 METAP1 (0.67) METAP1CA12CA1CA2CA7
SCHEMBL8083180 0.89 METAP1 (0.67) METAP1CA12CA1CA2CA7
SCHEMBL13848414 0.89 METAP1 (1.00) METAP1CA12CA1CA2CA7
SCHEMBL1495340 0.89 METAP1 (0.66) METAP1CA12CA1CA2CA7
SCHEMBL16543018 0.85 CGAS (0.70) METAP1CA12CA1CA2CA7
SCHEMBL2894955 0.84 METAP1 (1.00) METAP1MAPTALDH1A1POLBKMT2A
SCHEMBL4096609 0.84 METAP1 (1.00) METAP1CA12CA1CA2CA7

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-2010225-A2 METHODS AND COMPOSITIONS FOR TARGETING C-REL Cornell Research Foundation, Inc. (US) 2009-01-07 EP claimed
WO-2007120842-A2 METHODS AND COMPOSITIONS FOR TARGETING C-REL CORNELL RESEARCH FOUNDATION, INC. (US) 2007-10-25 WO claimed
US-9873674-B2 C-Rel inhibitors and uses thereof CORNELL UNIVERSITY (US) 2018-01-23 US disclosed
US-9873674-B2 C-Rel inhibitors and uses thereof CORNELL UNIVERSITY (US) 2018-01-23 US disclosed
US-20150218109-A1 C-REL INHIBITORS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-08-06 US disclosed
US-20150218109-A1 C-REL INHIBITORS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-08-06 US disclosed
WO-2014047232-A2 C-REL INHIBITORS AND USES THEREOF CORNELL UNIVERSITY (US) 2014-03-27 WO disclosed
WO-2014047232-A2 C-REL INHIBITORS AND USES THEREOF CORNELL UNIVERSITY (US) 2014-03-27 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-20150218109-A1 C-REL INHIBITORS AND USES THEREOF REL, NCOR1, CXCR4 METAP1 3547/4885CA12 4218/4885CA1 3479/4885

“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.