SCHEMBL6038445

SCHEMBL6038445

CCN(CC)CCNC(=O)n1ccc2cc(Oc3ccnc(N(C(=O)O)C(=O)Oc4ccccc4)c3)ccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 7/20 0.37
KDM4E B2RXH2 4/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
ABCB11 O95342 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
GAA P10253 1/20 0.35
CYP2D6 P10635 1/20 0.35
SCN1A P35498 1/20 0.35
OPRK1 P41145 1/20 0.35
KCNH2 Q12809 1/20 0.35
CACNA1C Q13936 1/20 0.35
SCN5A Q14524 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GHSR Q92847 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35

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
SCHEMBL5107633 0.97 MCHR1 (0.38) MCHR1KDM4EMEN1KMT2AALDH1A1
SCHEMBL5107637 0.91 MCHR1 (0.35) MCHR1KDM4EMEN1KMT2AALDH1A1
SCHEMBL6375561 0.90 KDR (0.35) GAAS1PR1KDR
SCHEMBL6038814 0.89 ASAH1 (0.36) S1PR1KDR
SCHEMBL6038768 0.88 SMN1; SMN2 (0.38) KMT2ASMN1; SMN2S1PR1KDRTSHR
SCHEMBL6038632 0.88 S1PR1 (0.35) GAAKCNH2S1PR1KDR
SCHEMBL5101397 0.87 KDR (0.36) GAAS1PR1KDR
SCHEMBL5105614 0.86 S1PR1 (0.43) S1PR1KDR
SCHEMBL5108282 0.86 MCHR1 (0.37) MCHR1KDM4EMEN1KMT2AALDH1A1
SCHEMBL5108441 0.86 ASAH1 (0.37) S1PR1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060004029-A1 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2006-01-05 US disclosed
EP-1522540-A1 AZAARENE DERIVATIVES Eisai Co., Ltd. (JP) 2005-04-13 EP 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-20060004029-A1 Nitrogen-containing aromatic derivatives NR0B2, NR0B1, NR4A1 MCHR1 599/4885KDM4E 2341/4885MEN1 3535/4885

“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.