SCHEMBL3510252

SCHEMBL3510252

O=C(O)c1cccc(Oc2ccc(F)c(-c3ncnc4c(Cl)cccc34)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.49
PPARG P37231 7/20 0.44
MRGPRX4 Q96LA9 1/20 0.44
AKR1C3 P42330 1/20 0.43
NR1H2 P55055 6/20 0.42
NR1H3 Q13133 6/20 0.42
NR4A2 P43354 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
NR4A1 P22736 1/20 0.39
NR4A3 Q92570 1/20 0.39

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
SCHEMBL3506200 0.89 NR1H2 (0.55) PPARGNR1H2NR1H3
SCHEMBL3350743 0.88 NR1H2 (0.46) NR1H2NR1H3
SCHEMBL27775786 0.84 KMT2A (0.40) KMOMEN1POLBKMT2A
SCHEMBL3509660 0.82 MAP4K4 (0.39) NR1H2NR1H3
SCHEMBL2448153 0.82 NR1H2 (0.40) KMONR1H2NR1H3MEN1KMT2A
SCHEMBL3507434 0.81 NR1H2 (0.58) NR1H2NR1H3
SCHEMBL2446322 0.81 NR1H3 (0.46) NR1H2NR1H3
SCHEMBL3348163 0.80 EGFR (0.38) NR1H2NR1H3
SCHEMBL2449201 0.79 FFAR4 (0.43) NR1H2NR1H3
SCHEMBL3507078 0.79 NR1H2 (0.48) NR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100273816-A1 Quinazoline Compounds WYETH LLC 2010-10-28 US claimed
CN-101679311-A Quinazoline compound WYETH CORP 2010-03-24 CN claimed
EP-2142517-A2 QUINAZOLINE COMPOUNDS Wyeth (US) 2010-01-13 EP claimed
WO-2009020683-A2 QUINAZOLINE COMPOUNDS WYETH (US) 2009-02-12 WO claimed
US-20100273816-A1 Quinazoline Compounds WYETH LLC 2010-10-28 US disclosed
CN-101679311-A Quinazoline compound WYETH CORP 2010-03-24 CN disclosed
EP-2142517-A2 QUINAZOLINE COMPOUNDS Wyeth (US) 2010-01-13 EP disclosed
WO-2009020683-A2 QUINAZOLINE COMPOUNDS WYETH (US) 2009-02-12 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 (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-20100273816-A1 Quinazoline Compounds NR1H3, NR1H2, NR1I3 KMO 1850/4885PPARG 63/4885MRGPRX4 41/4885

“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.