SCHEMBL8557768

SCHEMBL8557768

CCOC(=O)Cc1nc(-c2ccccc2)c(-c2ccccc2)o1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 14/20 0.68
NR4A1 P22736 3/20 0.68
NR4A3 Q92570 3/20 0.68
SMN1; SMN2 Q16637 1/20 0.60
KDM4E B2RXH2 2/20 0.58
HPGD P15428 2/20 0.58
ALDH1A1 P00352 1/20 0.58
KMT2A Q03164 1/20 0.57
RXRA P19793 7/20 0.57
RXRB P28702 6/20 0.57
RXRG P48443 3/20 0.57
ABCC4 O15439 1/20 0.57
C5 P01031 1/20 0.57
LMNA P02545 1/20 0.57
CHRM2 P08172 1/20 0.57
CYP3A4 P08684 1/20 0.57
CHRM1 P11229 1/20 0.57
DRD2 P14416 1/20 0.57
TSHR P16473 1/20 0.57
TBXA2R P21731 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
SCHEMBL7503163 0.90 PTGS2 (0.60) NR4A2NR4A1NR4A3SMN1; SMN2KDM4E
SCHEMBL7501153 0.90 PTGS2 (0.60) NR4A2NR4A1NR4A3SMN1; SMN2KDM4E
SCHEMBL7499580 0.89 NR4A2 (0.55) NR4A2NR4A1NR4A3SMN1; SMN2KDM4E
SCHEMBL7501262 0.89 NR4A2 (0.55) NR4A2NR4A1NR4A3SMN1; SMN2KDM4E
SCHEMBL12491008 0.89 KMT2A (0.61) NR4A2NR4A1NR4A3SMN1; SMN2KDM4E
SCHEMBL14664061 0.87 NR4A2 (0.51) NR4A2NR4A1NR4A3SMN1; SMN2KDM4E
SCHEMBL8139729 0.86 NR4A2 (0.71) NR4A2NR4A1NR4A3KDM4EHPGD
SCHEMBL8555035 0.83 NR4A2 (0.48) NR4A2NR4A1NR4A3SMN1; SMN2KDM4E
SCHEMBL8558809 0.83 NR4A2 (0.50) NR4A2NR4A1NR4A3SMN1; SMN2KDM4E
SCHEMBL14664012 0.83 KMT2A (0.53) NR4A2NR4A1NR4A3SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735398-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-27 US disclosed
US-8735398-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-27 US disclosed
US-20130085147-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-04 US disclosed
US-20130085147-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-04 US disclosed
US-8362020-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-29 US disclosed
US-8362020-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-29 US disclosed
US-20110294819-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2011-12-01 US disclosed
US-20110294819-A1 Hepatitis C Virus Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2011-12-01 US disclosed
EP-0582164-B1 Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles BRISTOL MYERS SQUIBB CO (US) 1998-12-23 EP disclosed
EP-0582164-A1 Adenosine re-uptake inhibiting derivatives of diphenyl oxazoles, thiazoles and imidazoles Bristol-Myers Squibb Company (US) 1994-02-09 EP disclosed
US-5187188-A Cardiovascular anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 1993-02-16 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-20110294819-A1 Hepatitis C Virus Inhibitors HAVCR2, MAVS, GTF3C1 NR4A2 3701/4885NR4A1 3394/4885NR4A3 3140/4885
US-20130085147-A1 Hepatitis C Virus Inhibitors HAVCR2, MAVS, GTF3C1 NR4A2 3701/4885NR4A1 3394/4885NR4A3 3140/4885

“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.