SCHEMBL6841317

SCHEMBL6841317

CON(C)C(=O)CSc1cccc(N)c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.38
CTSK P43235 1/20 0.37
MAPT P10636 1/20 0.36
HSD17B10 Q99714 1/20 0.35
CRBN Q96SW2 1/20 0.35
BACE1 P56817 1/20 0.35
CYP3A4 P08684 2/20 0.35
TP53 P04637 1/20 0.35
LTB4R Q15722 2/20 0.35
MTNR1A P48039 4/20 0.35
MTNR1B P49286 4/20 0.35
FFAR1 O14842 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KDM4E B2RXH2 1/20 0.34
CLK1 P49759 1/20 0.33

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
SCHEMBL6848229 0.82 APEX1 (0.61) APEX1MAPTHSD17B10TP53ALDH1A1
SCHEMBL10150422 0.82 FFAR1 (0.53) MAPTTP53FFAR1ALDH1A1
SCHEMBL10150451 0.81 ALDH1A1 (0.44) MAPTCRBNCYP3A4TP53MTNR1A
SCHEMBL8667113 0.79 MAPT (0.51) APEX1CTSKMAPTHSD17B10CYP3A4
SCHEMBL24046386 0.77 PKM (0.46) APEX1CTSKCRBNBACE1CYP3A4
SCHEMBL3911561 0.77 ALDH1A1 (0.51) MAPTHSD17B10TP53ALDH1A1KDM4E
SCHEMBL8870413 0.75 APEX1 (0.64) APEX1CRBNBACE1FFAR1ALDH1A1
SCHEMBL12350284 0.69 PBRM1 (0.49) HSD17B10CYP3A4ALDH1A1KDM4ECLK1
SCHEMBL24879103 0.69 MAPT (0.47) MAPTALDH1A1KDM4E
SCHEMBL17325394 0.68 GAA (0.49) APEX1MAPTHSD17B10FFAR1ALDH1A1

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 5 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
EP-1252146-A1 AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES AGOURON PHARMACEUTICALS, INC. (US) 2002-10-30 EP 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
WO-2001053274-A1 AMIDE COMPOUNDS FOR INHIBITING PROTEIN KINASES AGOURON PHARMACEUTICALS, INC. (US) 2001-07-26 WO 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 APEX1 2881/4885CTSK 767/4885MAPT 899/4885
US-20020103203-A1 Amide compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use BRAF, CNKSR1, UACA APEX1 2881/4885CTSK 767/4885MAPT 899/4885

“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.