SCHEMBL6845355

SCHEMBL6845355

COCNC(=O)CSc1cccc(NC(=O)c2ccc(OC(C)=O)c(C(C)(C)C)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 3/20 0.49
NR1H4 Q96RI1 1/20 0.42
LMNA P02545 4/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.41
POLB P06746 3/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 5/20 0.40
RAB9A P51151 4/20 0.40
TP53 P04637 3/20 0.40
NPC1 O15118 3/20 0.40
HTT P42858 2/20 0.40
GAA P10253 1/20 0.40
PKM P14618 3/20 0.39
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RECQL P46063 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL6841337 0.88 MAPT (0.45) TOP1NR1H4LMNAKMT2AMEN1
SCHEMBL6845356 0.84 TOP1 (0.49) TOP1NR1H4LMNAKMT2AMEN1
SCHEMBL6841338 0.71 SMN1; SMN2 (0.42) TOP1NR1H4LMNAKMT2AMEN1
SCHEMBL20064060 0.68 RAB9A (0.62) LMNAKMT2AMEN1MAPTPOLB
SCHEMBL6846921 0.68 GPR132 (0.51) TOP1KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL22650884 0.68 TSHR (0.50) TOP1NR1H4KMT2AMEN1ALDH1A1
SCHEMBL20073173 0.66 MAPT (0.62) LMNAKMT2AMEN1MAPTPOLB
SCHEMBL6844807 0.66 KMT2A (0.45) TOP1LMNAKMT2AMEN1MAPT
SCHEMBL6841190 0.64 TSHR (0.67) NR1H4LMNAALDH1A1RAB9AHTT
SCHEMBL5317036 0.63 HSD17B10 (0.63) LMNAKMT2AMEN1POLBALDH1A1

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
US-20040092747-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use BENDER STEVEN LEE (US) 2004-05-13 US disclosed
US-6635641-B2 For treating cancer and other disease states associated with unwanted angiogenesis and/or cellular proliferation such as diabetic retinopathy, neovascular glaucoma, rheumatoid arthritis, psoriasis AGOURON PHARMACEUTICALS, INC. 2003-10-21 US disclosed
US-20020103203-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. 2002-08-01 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 (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-20040092747-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use BRAF, CNKSR1, UACA TOP1 3356/4885NR1H4 3220/4885LMNA 4001/4885
US-20020103203-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use BRAF, CNKSR1, UACA TOP1 3356/4885NR1H4 3220/4885LMNA 4001/4885

“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.