SCHEMBL4057807

SCHEMBL4057807

Cn1ccnc1C(CC(c1nccn1C)c1nccn1C)c1nccn1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
CYP2D6 P10635 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
LPO P22079 1/20 0.43
MAPT P10636 2/20 0.42
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
ALOX12 P18054 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KMT2A Q03164 3/20 0.39
CNR1 P21554 1/20 0.38
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36
MEN1 O00255 1/20 0.36
FNTA P49354 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
SCHEMBL4057810 0.84 KDM4E (0.50) KDM4ECYP2D6L3MBTL1SMN1; SMN2LPO
SCHEMBL4065140 0.78 KDM4E (0.52) KDM4ECYP2D6L3MBTL1SMN1; SMN2LPO
SCHEMBL2474436 0.77 KDM4E (0.43) KDM4ECYP2D6L3MBTL1SMN1; SMN2LPO
SCHEMBL4060494 0.77 KDM4E (0.44) KDM4ECYP2D6L3MBTL1SMN1; SMN2LPO
SCHEMBL4065142 0.76 KDM4E (0.50) KDM4ECYP2D6L3MBTL1SMN1; SMN2LPO
SCHEMBL48851 0.76
SCHEMBL14148932 0.76 L3MBTL1 (0.46) KDM4ECYP2D6L3MBTL1SMN1; SMN2LPO
SCHEMBL1503496 0.75 KDM4E (0.63) KDM4ECYP2D6L3MBTL1MAPTTSHR
SCHEMBL1697176 0.74
SCHEMBL19143605 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7553988-B2 Method for producing coupling compound SUMITOMO CHEMICAL COMPANY, LIMTED (JP) 2009-06-30 US claimed
US-7553988-B2 Method for producing coupling compound SUMITOMO CHEMICAL COMPANY, LIMTED (JP) 2009-06-30 US disclosed
EP-1439157-B1 Method for producing Suzuki coupling compound catalysed by a nickel compound SUMITOMO CHEMICAL CO (JP) 2007-07-11 EP disclosed
US-7217677-B2 Method for producing coupling compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-15 US disclosed
US-20060281925-A1 METHOD FOR PRODUCING COUPLING COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-12-14 US disclosed
US-20040161404-A1 Method for producing coupling compound SUMITOMO CHEMICAL COMPANY, LIMITED 2004-08-19 US disclosed
EP-1439157-A2 Method for producing Suzuki coupling compound catalysed by a nickel compound Sumitomo Chemical Co.,Ltd. (JP) 2004-07-21 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 (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-20060281925-A1 METHOD FOR PRODUCING COUPLING COMPOUND RPL22, CYP4A22, PYM1 KDM4E 4615/4885CYP2D6 1373/4885L3MBTL1 4107/4885
US-20040161404-A1 Method for producing coupling compound PYM1, MALT1, BET1 KDM4E 4304/4885CYP2D6 2500/4885L3MBTL1 2180/4885

“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.