SCHEMBL5500673

SCHEMBL5500673

CCOC(=O)c1cnc2ccccc2c1NCCCCCNc1ncccn1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.72
MEN1 O00255 2/20 0.72
PKM P14618 1/20 0.72
MAPT P10636 7/20 0.60
NPSR1 Q6W5P4 2/20 0.60
ALDH1A1 P00352 6/20 0.59
KDM4E B2RXH2 5/20 0.59
TP53 P04637 2/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
MAPK1 P28482 3/20 0.55
POLB P06746 1/20 0.53
RAD52 P43351 1/20 0.53
UHRF1 Q96T88 1/20 0.53
HPGD P15428 3/20 0.53
LMNA P02545 3/20 0.52
TDP1 Q9NUW8 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
AURKA O14965 2/20 0.52
AURKB Q96GD4 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL2045638 0.89 KMT2A (0.79) KMT2AMEN1PKMMAPTNPSR1
SCHEMBL5501524 0.88 KMT2A (0.74) KMT2AMEN1PKMMAPTNPSR1
SCHEMBL5506586 0.87 KMT2A (0.76) KMT2AMEN1PKMMAPTNPSR1
SCHEMBL5501450 0.87 KMT2A (0.76) KMT2AMEN1PKMMAPTNPSR1
SCHEMBL5505918 0.86 KMT2A (0.77) KMT2AMEN1PKMMAPTNPSR1
SCHEMBL530155 0.84 KMT2A (0.78) KMT2AMEN1PKMMAPTNPSR1
SCHEMBL5505490 0.82 KMT2A (0.65) KMT2AMEN1PKMMAPTNPSR1
SCHEMBL5315591 0.81 KMT2A (0.77) KMT2AMEN1PKMMAPTNPSR1
SCHEMBL5981802 0.81 MEN1 (0.50) KMT2AMEN1PKMMAPTNPSR1
SCHEMBL9175601 0.80 MEN1 (0.74) KMT2AMEN1PKMMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753724-A1 HETEROCYCLIC DERIVATIVES FOR TREATMENT OF HYPERLIPIDEMIA AND RELATED DISEASES AVANIR PHARMACEUTICALS (US) 2007-02-21 EP disclosed
US-20060009487-A1 Heterocyclic derivatives for treatment of hyperlipidemia and related diseases SIRCAR JAGADISH C 2006-01-12 US disclosed
WO-2005123686-A1 HETEROCYCLIC DERIVATIVES FOR TREATMENT OF HYPERLIPIDEMIA AND RELATED DISEASES AVANIR PHARMACEUTICALS (US) 2005-12-29 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-20060009487-A1 Heterocyclic derivatives for treatment of hyperlipidemia and related diseases LDLR, NPC1L1, CETP KMT2A 3106/4885MEN1 4136/4885PKM 1796/4885

“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.