SCHEMBL4774064

SCHEMBL4774064

CN1CCC(C(C)(C)c2ccc(NC(=O)c3cccnc3Nc3ccc4nc[nH]c(=O)c4c3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
MAPT P10636 5/20 0.41
ALDH1A1 P00352 2/20 0.41
GAA P10253 2/20 0.41
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MET P08581 1/20 0.39
IP6K1 Q92551 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
BRAF P15056 1/20 0.37
EGFR P00533 2/20 0.37
ERBB2 P04626 1/20 0.37
FLT3 P36888 1/20 0.36
MELK Q14680 1/20 0.36
AXL P30530 1/20 0.36
KDR P35968 1/20 0.36
MAT2A P31153 1/20 0.36

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
SCHEMBL4770421 0.83 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL4773975 0.83 MAPT (0.44) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL3890618 0.80 KDR (0.60) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL3141747 0.77 KDR (0.47) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL4773961 0.76 PDPK1 (0.40) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL3156233 0.76 KDR (0.51) MEN1KMT2AMAPTLMNAKDR
SCHEMBL447100 0.75 ALDH1A1 (0.44) MEN1KMT2AALDH1A1POLBHTR1F
SCHEMBL447011 0.74 KDR (0.66) BRAFEGFRFLT3KDR
SCHEMBL6223371 0.74 KDR (0.48) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL4770798 0.73 KMT2A (0.39) MEN1KMT2AMAPTALDH1A1GAA

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
EP-1562933-B1 SUBSTITUTED AMINE DERIVATIVES AND METHODS OF USE IN THE TREATMENT OF ANGIOGENESIS RELATED DISORDERS AMGEN INC (US) 2008-03-19 EP claimed
US-7102009-B2 Substituted amine derivatives and methods of use AMGEN INC. (US) 2006-09-05 US claimed
US-20030203922-A1 Substituted amine derivatives and methods of use AMGEN INC. 2003-10-30 US claimed
EP-1562933-B1 SUBSTITUTED AMINE DERIVATIVES AND METHODS OF USE IN THE TREATMENT OF ANGIOGENESIS RELATED DISORDERS AMGEN INC (US) 2008-03-19 EP disclosed
EP-1562933-B1 SUBSTITUTED AMINE DERIVATIVES AND METHODS OF USE IN THE TREATMENT OF ANGIOGENESIS RELATED DISORDERS AMGEN INC (US) 2008-03-19 EP disclosed
US-7102009-B2 Substituted amine derivatives and methods of use AMGEN INC. (US) 2006-09-05 US disclosed
EP-1562933-A2 SUBSTITUTED AMINE DERIVATIVES AND METHODS OF USE IN THE TREATMENT OF ANGIOGENESIS RELATED DISORDERS Amgen Inc. (US) 2005-08-17 EP disclosed
WO-2004007481-A2 SUBSTITUTED AMINE DERIVATIVES AND METHODS OF USE IN THE TREATMENT OF ANGIOGENESIS RELATES DISORDERS AMGEN INC. (US) 2004-01-22 WO disclosed
US-20030203922-A1 Substituted amine derivatives and methods of use AMGEN INC. 2003-10-30 US 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-20030203922-A1 Substituted amine derivatives and methods of use MAOB, HNMT, FLT4 MEN1 664/4885KMT2A 1259/4885MAPT 2262/4885

“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.