SCHEMBL3338474

SCHEMBL3338474

CC(C)Oc1nc(N)nc2ccc(-c3ccc(C(=O)N4CCCCC4)cc3)cc12

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 15/20 0.44
MAPK1 P28482 1/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
CSF1R P07333 1/20 0.42
ALDH1A1 P00352 1/20 0.41
TLR8 Q9NR97 1/20 0.41
TLR7 Q9NYK1 1/20 0.41

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
SCHEMBL3335847 0.90 HPGD (0.43) HPGDMEN1KMT2AALDH1A1
SCHEMBL3333349 0.90 JAK2 (0.53) HPGDMEN1KMT2ACSF1RTLR8
SCHEMBL3336761 0.86 HPGD (0.51) HPGDMAPK1CSF1RALDH1A1
SCHEMBL5129519 0.85 MGLL (0.40) HPGDMEN1GAAHTTKMT2A
SCHEMBL3335650 0.84 HPGD (0.50) HPGDMAPK1MEN1GAAKMT2A
SCHEMBL5132766 0.84 HSD17B10 (0.49) HPGDMAPK1CSF1RALDH1A1TLR8
SCHEMBL3336025 0.82 HPGD (0.45) HPGDMAPK1CSF1R
SCHEMBL3336523 0.82 IP6K1 (0.47) GAAALDH1A1
SCHEMBL3336495 0.80 MKNK1 (0.42) HPGDMEN1HTTKMT2AALDH1A1
SCHEMBL3338819 0.80 CYP3A4 (0.47) HPGDMAPK1MEN1KMT2AALDH1A1

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 2 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

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 HPGD 3242/4885MAPK1 3259/4885MEN1 2284/4885

“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.