SCHEMBL6845356

SCHEMBL6845356

CON(C)C(=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 2/20 0.42
LMNA P02545 3/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 6/20 0.41
TP53 P04637 4/20 0.41
MAPT P10636 1/20 0.41
ALDH1A1 P00352 2/20 0.41
POLB P06746 2/20 0.41
RAB9A P51151 5/20 0.40
NPC1 O15118 4/20 0.40
MEN1 O00255 1/20 0.40
HTT P42858 2/20 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
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL6841338 0.88 SMN1; SMN2 (0.42) TOP1NR1H4LMNAKMT2ASMN1; SMN2
SCHEMBL6845355 0.84 TOP1 (0.49) TOP1NR1H4LMNAKMT2ASMN1; SMN2
SCHEMBL6841337 0.71 MAPT (0.45) TOP1NR1H4LMNAKMT2ASMN1; SMN2
SCHEMBL6846635 0.70 NPC1 (0.57) KMT2ATP53MAPTPOLBRAB9A
SCHEMBL20064060 0.68 RAB9A (0.62) LMNAKMT2ASMN1; SMN2TP53MAPT
SCHEMBL6846921 0.68 GPR132 (0.51) TOP1KMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL22650884 0.68 TSHR (0.50) TOP1NR1H4KMT2AALDH1A1RAB9A
SCHEMBL6848229 0.67 APEX1 (0.61) KMT2ASMN1; SMN2TP53MAPTALDH1A1
SCHEMBL6841317 0.66 APEX1 (0.38) TP53MAPTALDH1A1
SCHEMBL20073173 0.66 MAPT (0.62) LMNAKMT2ATP53MAPTPOLB

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.