SCHEMBL14857060

SCHEMBL14857060

O=C(O)CCCC(=O)Nc1ccccc1C(=O)Nc1ccccc1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.59
NPC1 O15118 2/20 0.59
RAB9A P51151 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
TDP1 Q9NUW8 1/20 0.58
HDAC3 O15379 1/20 0.57
HDAC4 P56524 1/20 0.57
HDAC1 Q13547 1/20 0.57
HDAC7 Q8WUI4 1/20 0.57
HDAC2 Q92769 1/20 0.57
HDAC10 Q969S8 1/20 0.57
HDAC11 Q96DB2 1/20 0.57
HDAC8 Q9BY41 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
HDAC9 Q9UKV0 1/20 0.57
HDAC5 Q9UQL6 1/20 0.57
PPARG P37231 3/20 0.55
HCAR2 Q8TDS4 2/20 0.54
KMT2A Q03164 3/20 0.54
ALDH1A1 P00352 1/20 0.53

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
SCHEMBL15183763 0.91 KMT2A (0.56) KDM4ENPC1RAB9ASMN1; SMN2HDAC3
SCHEMBL7824993 0.84 KMT2A (0.63) KDM4ENPC1RAB9ASMN1; SMN2HCAR2
SCHEMBL6800486 0.83 ALDH1A1 (0.57) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL14857026 0.83 SMN1; SMN2 (0.63) KDM4ESMN1; SMN2TDP1ALDH1A1HSD17B10
SCHEMBL21665202 0.82 HTT (0.60) KDM4ETDP1HDAC3HDAC4HDAC1
SCHEMBL16404495 0.82 KMT2A (0.69) KDM4ENPC1RAB9ASMN1; SMN2HCAR2
SCHEMBL3503890 0.82 MEN1 (0.63) KDM4ESMN1; SMN2TDP1HDAC3HDAC4
SCHEMBL7652591 0.82 MAPK1 (0.56) KDM4ENPC1RAB9ASMN1; SMN2TDP1
SCHEMBL9532980 0.80 CYP2C9 (0.69) KDM4ENPC1RAB9ASMN1; SMN2HCAR2
SCHEMBL14855999 0.79 ALDH1A1 (0.73) KDM4ESMN1; SMN2KMT2AALDH1A1HPGD

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
US-8993622-B2 Antiviral compounds EIRIUM AB (SE) 2015-03-31 US claimed
US-20130210915-A1 ANTIVIRAL COMPOUNDS EIRIUM AB (SE) 2013-08-15 US claimed
EP-2580190-A1 NEW ANTIVIRAL COMPOUNDS Wadell, Göran (SE) 2013-04-17 EP claimed
WO-2011155898-A1 NEW ANTIVIRAL COMPOUNDS WADELL GOERAN (SE) 2011-12-15 WO claimed
US-8993622-B2 Antiviral compounds EIRIUM AB (SE) 2015-03-31 US disclosed
US-20130210915-A1 ANTIVIRAL COMPOUNDS EIRIUM AB (SE) 2013-08-15 US disclosed
EP-2580190-A1 NEW ANTIVIRAL COMPOUNDS Wadell, Göran (SE) 2013-04-17 EP disclosed
WO-2011155898-A1 NEW ANTIVIRAL COMPOUNDS WADELL GOERAN (SE) 2011-12-15 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-20130210915-A1 ANTIVIRAL COMPOUNDS MAVS, ZC3HAV1, EIF2AK2 KDM4E 2866/4885NPC1 620/4885RAB9A 2209/4885

“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.