SCHEMBL2548769

SCHEMBL2548769

CCCc1cc(C(=O)Cc2ccccn2)c(O)cc1O

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.60
LMNA P02545 7/20 0.60
HTT P42858 4/20 0.60
GAA P10253 3/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
MAPT P10636 11/20 0.58
XBP1 P17861 1/20 0.57
HIF1A Q16665 1/20 0.57
ALDH1A1 P00352 6/20 0.57
MEN1 O00255 6/20 0.57
KMT2A Q03164 6/20 0.57
HPGD P15428 6/20 0.57
ALOX12 P18054 3/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
TDP1 Q9NUW8 1/20 0.54
SHBG P04278 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
SCHEMBL5311650 0.93 KDM4E (0.58) KDM4ELMNAHTTGAASMN1; SMN2
SCHEMBL2546358 0.75 MAPT (0.70) KDM4ELMNAHTTGAASMN1; SMN2
SCHEMBL17985011 0.74 KDM4E (0.60) KDM4ELMNAHTTGAASMN1; SMN2
SCHEMBL17120008 0.74 MAPT (0.64) KDM4ELMNAHTTGAASMN1; SMN2
Iodide SCHEMBL6263376 0.73 KDM4E (0.59) KDM4ELMNAHTTGAASMN1; SMN2
SCHEMBL17120019 0.71 MEN1 (0.64) KDM4ELMNAHTTGAASMN1; SMN2
SCHEMBL17120014 0.71 MAPT (0.83) KDM4ELMNAHTTGAASMN1; SMN2
SCHEMBL7981204 0.70 CTNNB1 (0.60) KDM4EGAASMN1; SMN2MAPTALDH1A1
SCHEMBL3452459 0.70 RAB9A (0.62) KDM4ESMN1; SMN2MAPTALDH1A1HPGD
SCHEMBL17120017 0.70 MAPT (0.62) KDM4ELMNAHTTGAASMN1; SMN2

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-9408826-B2 Isoflavone anti-viral compounds Kineta, Inc. (US) 2016-08-09 US disclosed
US-9408826-B2 Isoflavone anti-viral compounds Kineta, Inc. (US) 2016-08-09 US disclosed
US-9408826-B2 Isoflavone anti-viral compounds Kineta, Inc. (US) 2016-08-09 US disclosed
EP-2560652-A2 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2013-02-27 EP disclosed
US-20110262482-A1 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 US disclosed
US-20110262482-A1 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 US disclosed
US-20110262482-A1 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 US disclosed
WO-2011133728-A2 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 WO disclosed
WO-2011133728-A2 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 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-20110262482-A1 ANTI-VIRAL COMPOUNDS MAVS, EIF2AK2, IRF3 KDM4E 2601/4885LMNA 3282/4885HTT 3418/4885

“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.