SCHEMBL6500550

SCHEMBL6500550

Cc1ccc(NC(=O)NCCc2ccccc2)c(C(=O)O)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.56
POLB P06746 1/20 0.56
ALDH1A1 P00352 3/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
LMNA P02545 1/20 0.54
ALOX12 P18054 1/20 0.54
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
TRPV1 Q8NER1 1/20 0.53
MEN1 O00255 3/20 0.52
GFER P55789 1/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
CFD P00746 1/20 0.51
PLK1 P53350 4/20 0.51
PLK3 Q9H4B4 1/20 0.51
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50

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
SCHEMBL6565629 0.85 CXCR2 (0.62) KMT2APOLBALDH1A1L3MBTL1LMNA
SCHEMBL6495814 0.84 CNR1 (0.63) KMT2AALDH1A1LMNAALOX12CYP1A2
SCHEMBL6500793 0.84 PTPRC (0.54) KMT2ATRPV1MEN1NPC1RAB9A
SCHEMBL27358385 0.83 CFD (0.72) KMT2AALDH1A1L3MBTL1TRPV1MEN1
SCHEMBL19472769 0.78 KMT2A (0.55) KMT2APOLBALDH1A1TRPV1MEN1
SCHEMBL10192078 0.77 ALDH1A1 (0.83) KMT2AALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL4354544 0.77 TRPV1 (0.67) KMT2ATRPV1MEN1NPC1RAB9A
SCHEMBL10192070 0.77 KMT2A (0.82) KMT2APOLBALDH1A1LMNACYP1A2
SCHEMBL10362772 0.76 ALDH1A1 (0.75) KMT2AALDH1A1LMNATRPV1NPC1
SCHEMBL19472763 0.75 CNR1 (0.55) KMT2AALDH1A1LMNAALOX12CYP1A2

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-20050032793-A1 2-amino-benzoxazinones for the treatment of viral infections G.D. SEARLE & CO. (US) 2005-02-10 US disclosed
US-6683077-B2 4H-3,1-BENZOXAZIN-4-ONE COMPOUNDS OF GIVEN FORMULA; HERPES INFECTIONS; ASSEMBLIN PROTEASE INHIBITORS G.D. SEARLE & CO. 2004-01-27 US disclosed
US-20030022895-A1 2-Amino-benzoxazinones for the treatment of viral infections G.D. SEARLE & CO. 2003-01-30 US disclosed
US-6380189-B1 FOR TREATING HERPES-RELATED DISORDERS G.D. SEARLE & CO. 2002-04-30 US disclosed
EP-0828721-B1 2-AMINO-BENZOXAZINONES FOR THE TREATMENT OF VIRAL INFECTIONS SEARLE & CO (US) 2001-11-14 EP disclosed
CN-1070480-C 2-amino-benzoxanones for the treatment of viral infections SEARLE & CO (US) 2001-09-05 CN disclosed
EP-1122245-A2 2-Amino-benzoxazinones for the treatment of viral infections G.D. Searle & Co. (US) 2001-08-08 EP disclosed
US-5985872-A THERAPEUTIC TREATMENT OF HERPES VIRAL INFECTION G.D. SEARLE & CO. (US) 1999-11-16 US disclosed
WO-1996037485-A1 2-AMINO-BENZOXAZINONES FOR THE TREATMENT OF VIRAL INFECTIONS G.D. SEARLE & CO. (US) 1996-11-28 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 (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-20030022895-A1 2-Amino-benzoxazinones for the treatment of viral infections IFNAR1, IL4I1, HAX1 KMT2A 1555/4885POLB 2432/4885ALDH1A1 1022/4885
US-20050032793-A1 2-amino-benzoxazinones for the treatment of viral infections IFNAR1, IL4I1, ACE2 KMT2A 1859/4885POLB 2489/4885ALDH1A1 1858/4885

“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.