SCHEMBL5621447

SCHEMBL5621447

COc1cc2[nH]c(N(C)Cc3cc(Cl)ccn3)nc(=O)c2c(OC)c1OC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.35
▸ GAK O14976 2/20 0.32
▸ RIPK2 O43353 1/20 0.32
▸ COQ8A Q8NI60 1/20 0.32
▸ NLK Q9UBE8 1/20 0.32
▸ WDR5 P61964 1/20 0.32
▸ FABP4 P15090 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ LMNA P02545 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ BRD4 O60885 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ KDR P35968 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ PDGFRB P09619 1/20 0.31
▸ KIT P10721 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ AMY1A P0DUB6 1/20 0.31

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
SCHEMBL5620824 0.87 MAPT (0.34) KDM4EALDH1A1SMN1; SMN2MAPTPOLB
SCHEMBL5621801 0.85 NOS2 (0.37) TDP1KDM4ELMNAMAPTPOLB
SCHEMBL5620309 0.84 PARP1 (0.32) KDM4EALDH1A1BRD4HPGD
SCHEMBL5655062 0.78 NOS2 (0.36) TDP1KDM4ELMNAMAPTPOLB
SCHEMBL5621260 0.77 PIM1 (0.37) FABP4KDM4EALDH1A1NPC1SMN1; SMN2
SCHEMBL5620564 0.77 PARP1 (0.31) KDM4EALDH1A1BRD4
SCHEMBL5622444 0.77 ACHE (0.40) FABP4NPC1SMN1; SMN2KMT2A
SCHEMBL5621249 0.77 PARP1 (0.39) FABP4LMNAMAPK1KMT2A
SCHEMBL5621912 0.77 GRIN2D (0.33) KDM4EALDH1A1MAPTPOLBHPGD
SCHEMBL5620510 0.77 ALDH1A1 (0.33) KDM4EALDH1A1SMN1; SMN2MAPTPOLB

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-20050038016-A1 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ROCHE PALO ALTO LLC 2005-02-17 — — US claimed
US-20070265446-A1 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists CONNOLLY TERRENCE J 2007-11-15 — — US disclosed
US-20070265446-A1 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists CONNOLLY TERRENCE J 2007-11-15 — — US disclosed
US-20070265446-A1 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists CONNOLLY TERRENCE J 2007-11-15 — — US disclosed
US-7244738-B2 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ROCHE PALO ALTO LLC (US) 2007-07-17 — — US disclosed
US-7244738-B2 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ROCHE PALO ALTO LLC (US) 2007-07-17 — — US disclosed
US-7244738-B2 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ROCHE PALO ALTO LLC (US) 2007-07-17 — — US disclosed
US-20050038016-A1 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ROCHE PALO ALTO LLC 2005-02-17 — — 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 (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-20070265446-A1 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ADRB1, ADRA1A, ADRA1B TDP1 2865/4885GAK 2196/4885RIPK2 4431/4885
US-20050038016-A1 Arylamine-substituted quinazolinone compounds useful as alpha 1A/B adrenergic receptor antagonists ADRB1, ADRA1A, ADRA1B TDP1 2865/4885GAK 2196/4885RIPK2 4431/4885

“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.

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