SCHEMBL4418540

SCHEMBL4418540

Cc1cc(-n2c(=O)[nH]c3cc(N(Cc4ccc(F)cc4)C(=O)OC(C)(C)C)ccc3c2=O)ccc1N

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HTR3A P46098 2/20 0.36
▸ SMN1; SMN2 Q16637 4/20 0.36
▸ LMNA P02545 2/20 0.36
▸ TP53 P04637 3/20 0.35
▸ RXFP1 Q9HBX9 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ GRM2 Q14416 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ QPCT Q16769 1/20 0.34
▸ GAA P10253 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL4425571 0.92 RXFP1 (0.36) HTR3ASMN1; SMN2LMNATP53RXFP1
SCHEMBL13634870 0.86 SMN1; SMN2 (0.45) HTR3ASMN1; SMN2LMNATP53RXFP1
SCHEMBL4425764 0.82 TP53 (0.45) SMN1; SMN2LMNATP53RXFP1MAPT
SCHEMBL2069707 0.71 PDK2 (0.41) LMNAALDH1A1MEN1KMT2A
SCHEMBL23609272 0.71 STAT5B (0.46) LMNAALDH1A1MEN1KMT2ANPC1
SCHEMBL18721166 0.69 KCNQ4 (0.43) GRM2
SCHEMBL15156657 0.69 NR1D1 (0.43) LMNAMAPTALDH1A1GRM2MEN1
SCHEMBL14525736 0.67 ALDH1A1 (0.42) HTR3ASMN1; SMN2LMNATP53RXFP1
SCHEMBL3063916 0.65 KCNQ4 (0.43) GRM2
SCHEMBL27657927 0.65 ERCC1 (0.41) HTR3ASMN1; SMN2LMNATP53RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1668002-B1 2,4-DIOXO-3-QUINAZOLINYLARYL SULFONYLUREAS PORTOLA PHARM INC (US) 2009-11-11 — — EP disclosed
EP-1668002-B1 2,4-DIOXO-3-QUINAZOLINYLARYL SULFONYLUREAS PORTOLA PHARM INC (US) 2009-11-11 — — EP disclosed
EP-1668002-A4 2,4-DIOXO-3-QUINAZOLINYLARYL SULFONYLUREAS PORTOLA PHARM INC (US) 2006-12-20 — — EP disclosed
US-7109332-B2 2,4-dioxo-3-quinazolinylaryl sulfonylureas PORTOLA PHARMACEUTICALS, INC. (US) 2006-09-19 — — US disclosed
EP-1668002-A2 2,4-DIOXO-3-QUINAZOLINYLARYL SULFONYLUREAS Portola Pharmaceuticals, Inc. (US) 2006-06-14 — — EP disclosed
US-20050107357-A1 2,4-dioxo-3-quinazolinylaryl sulfonylureas PORTOLA PHARMACEUTICALS, INC. (US) 2005-05-19 — — US disclosed
WO-2005032488-A2 2,4-DIOXO-3-QUINAZOLINYLARYL SULFONYLUREAS PORTOLA PHARMACEUTICALS, INC. (US) 2005-04-14 — — 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-20050107357-A1 2,4-dioxo-3-quinazolinylaryl sulfonylureas PFKP, DPP3, P2RY13 HTR3A 423/4885SMN1; SMN2 4038/4885LMNA 4078/4885

“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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