SCHEMBL4716633

SCHEMBL4716633

NC(=O)c1ccccc1NC(=O)c1ccccc1F

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
PDCD1 Q15116 1/20 0.58
CD274 Q9NZQ7 1/20 0.58
L3MBTL1 Q9Y468 3/20 0.57
LMNA P02545 1/20 0.56
HTT P42858 3/20 0.55
ALDH1A1 P00352 2/20 0.55
USP2 O75604 1/20 0.55
GLA P06280 1/20 0.55
TSHR P16473 1/20 0.55
ATM Q13315 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
BCL3 P20749 1/20 0.55
KCNMA1 Q12791 1/20 0.54
GAA P10253 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 1/20 0.53

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
SCHEMBL15463572 0.85 HTT (0.70) TDP1MEN1KMT2AL3MBTL1LMNA
SCHEMBL4710843 0.84 TP53 (0.69) TDP1MEN1KMT2ALMNAALDH1A1
SCHEMBL14855912 0.83 L3MBTL1 (0.61) TDP1MEN1KMT2AL3MBTL1LMNA
SCHEMBL13316080 0.82 PDCD1 (0.66) MEN1KMT2APDCD1CD274HTT
SCHEMBL27471728 0.81 MEN1 (0.74) TDP1MEN1KMT2AL3MBTL1LMNA
SCHEMBL31098214 0.81 HTT (0.73) TDP1MEN1KMT2AL3MBTL1LMNA
SCHEMBL2606255 0.81 NPC1 (0.64) PDCD1CD274LMNAALDH1A1GLA
SCHEMBL11284668 0.81 PDCD1 (0.64) MEN1KMT2APDCD1CD274ALDH1A1
SCHEMBL14252955 0.80 PDCD1 (0.72) TDP1MEN1KMT2APDCD1CD274
SCHEMBL16431496 0.80 BCL3 (0.62) TDP1MEN1KMT2AL3MBTL1ALDH1A1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160185740-A1 2-BENZOYLAMINOBENZAMIDE DERIVATIVES AS BCL-3 INHIBITORS UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2016-06-30 US disclosed
US-8268857-B2 Compositions and methods for inhibiting TGF-β MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-09-18 US disclosed
US-8268857-B2 Compositions and methods for inhibiting TGF-β MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-09-18 US disclosed
US-8268857-B2 Compositions and methods for inhibiting TGF-β MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-09-18 US disclosed
EP-1603908-B1 QUINAZOLINE DERIVATIVES AS TGF-BETA INHIBITORS MILLENNIUM PHARM INC (US) 2008-06-11 EP disclosed
EP-1603908-B1 QUINAZOLINE DERIVATIVES AS TGF-BETA INHIBITORS MILLENNIUM PHARM INC (US) 2008-06-11 EP disclosed
US-20070142408-A1 Compositions and methods for inhibiting TGF-Beta MILLENNIUM PHARMACEUTICALS, INC. 2007-06-21 US disclosed
US-20070142408-A1 Compositions and methods for inhibiting TGF-Beta MILLENNIUM PHARMACEUTICALS, INC. 2007-06-21 US disclosed
US-20070142408-A1 Compositions and methods for inhibiting TGF-Beta MILLENNIUM PHARMACEUTICALS, INC. 2007-06-21 US disclosed
US-7189733-B2 Compositions and methods for inhibiting TGF-β MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-03-13 US disclosed
US-7189733-B2 Compositions and methods for inhibiting TGF-β MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-03-13 US disclosed
US-7189733-B2 Compositions and methods for inhibiting TGF-β MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-03-13 US disclosed
EP-1603908-A1 QUINAZOLINE DERIVATIVES AS TGF-BETA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-12-14 EP disclosed
US-20040204431-A1 Compositions and methods for inhibiting TGF-beta MILLENNIUM PHARMACEUTICALS, INC. 2004-10-14 US disclosed
WO-2004081009-A1 QUINAZOLINE DERIVATIVES AS TGF-BETA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2004-09-23 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 (3 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-20040204431-A1 Compositions and methods for inhibiting TGF-beta TGFB1, TGFBR2, TGFB2 TDP1 3339/4885MEN1 1065/4885KMT2A 2127/4885
US-20160185740-A1 2-BENZOYLAMINOBENZAMIDE DERIVATIVES AS BCL-3 INHIBITORS BCL3, BCL2, BCL2A1 TDP1 3721/4885MEN1 1681/4885KMT2A 1055/4885
US-20070142408-A1 Compositions and methods for inhibiting TGF-Beta TGFB1, TGFB2, TGFBR1 TDP1 3577/4885MEN1 853/4885KMT2A 2427/4885

“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.