SCHEMBL3546147

SCHEMBL3546147

CN(C)CCCNC(=O)c1cc(Cl)ccn1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.62
MALT1 Q9UDY8 2/20 0.53
POLB P06746 3/20 0.51
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 2/20 0.50
MAPT P10636 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KDM4C Q9H3R0 1/20 0.50
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
KDM4E B2RXH2 2/20 0.48
AGTR1 P30556 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MEN1 O00255 1/20 0.48
FERMT2 Q96AC1 1/20 0.48
FYN P06241 1/20 0.48

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
SCHEMBL2655766 0.93 ALOX15 (0.53) ALOX15MALT1KMT2AALDH1A1HPGD
SCHEMBL27918571 0.86 ALDH1A1 (0.52) ALOX15POLBKMT2AALDH1A1HPGD
SCHEMBL13822112 0.84 KDM4E (0.58) ALOX15POLBKMT2AALDH1A1MAPT
SCHEMBL6072425 0.83 KDM4E (0.60) ALOX15POLBKMT2AALDH1A1MAPT
SCHEMBL14894349 0.83 KMT2A (0.55) POLBKMT2AKDM4CNPC1RAB9A
SCHEMBL14904964 0.83 KMT2A (0.52) POLBKMT2AKDM4CNPC1RAB9A
SCHEMBL6072144 0.82 L3MBTL1 (0.55) ALOX15POLBKMT2AALDH1A1HPGD
SCHEMBL620675 0.82 KDM4C (0.54) MALT1POLBKMT2AALDH1A1HPGD
SCHEMBL14904965 0.81 KMT2A (0.50) MALT1POLBKMT2AKDM4CSMN1; SMN2
SCHEMBL3504843 0.80 MAOB (0.63) MALT1POLBKMT2AALDH1A1MAPT

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-7652041-B2 4-[4-(3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}propyl)phenoxy]pyridino-2-carboxamido: N-methyl-4-[4-(3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}propyl)phenoxy]pyridine-2-carboxamide: Raf-kinase inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-01-26 US disclosed
US-20060160803-A1 Cinnamide and hydrocinnamide derivatives with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-07-20 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-20060160803-A1 Cinnamide and hydrocinnamide derivatives with kinase inhibitory activity MAP3K21, HIPK4, MAP3K20 ALOX15 3525/4885MALT1 4254/4885POLB 4748/4885

“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.