SCHEMBL3334286

SCHEMBL3334286

CC(=O)Nc1ccc(-c2ccc3nc(NC(C)=O)nc(O)c3c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
HTT P42858 1/20 0.51
BRAF P15056 1/20 0.51
MAPK10 P53779 1/20 0.49
KMT2A Q03164 9/20 0.48
KDM4E B2RXH2 8/20 0.48
MEN1 O00255 7/20 0.48
ALDH1A1 P00352 6/20 0.48
MAPT P10636 5/20 0.48
HPGD P15428 3/20 0.48
RXFP1 Q9HBX9 2/20 0.48
PDE10A Q9Y233 2/20 0.47
SULT1A1 P50225 1/20 0.47
ADORA3 P0DMS8 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
CYP2C19 P33261 1/20 0.47
POLB P06746 2/20 0.45

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
SCHEMBL3333818 0.88 ADORA3 (0.45) BRAFKDM4EALDH1A1HPGDADORA3
SCHEMBL4359201 0.85 MAP4K4 (0.53) SMN1; SMN2L3MBTL1HTTBRAFMAPK10
SCHEMBL3334682 0.85 HTT (0.50) SMN1; SMN2L3MBTL1HTTBRAFMAPK10
SCHEMBL4351159 0.83 BRAF (0.48) SMN1; SMN2L3MBTL1HTTBRAFMAPK10
SCHEMBL4362769 0.83 MAPK10 (0.49) SMN1; SMN2L3MBTL1HTTBRAFMAPK10
SCHEMBL3336432 0.83 BRAF (0.48) SMN1; SMN2L3MBTL1HTTBRAFMAPK10
SCHEMBL3333630 0.82 PIK3CG (0.54) SMN1; SMN2BRAFKMT2AKDM4EMEN1
SCHEMBL3336752 0.80 BRAF (0.46) SMN1; SMN2L3MBTL1HTTBRAFMAPK10
SCHEMBL3331750 0.80 TTK (0.48) SMN1; SMN2L3MBTL1HTTBRAFMAPK10
SCHEMBL3338081 0.80 BRAF (0.46) SMN1; SMN2L3MBTL1HTTBRAFMAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8673929-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives and pharmaceutical compositions useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-03-18 US claimed
US-20100143299-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2010-06-10 US claimed
US-8673929-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives and pharmaceutical compositions useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-03-18 US disclosed
US-20100143299-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2010-06-10 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-20100143299-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING VIRAL INFECTIONS OPRD1, IFNAR1, NR4A1 SMN1; SMN2 3749/4885L3MBTL1 3418/4885HTT 3738/4885

“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.