SCHEMBL4421833

SCHEMBL4421833

COc1cc(C(=O)NS(=O)(=O)c2ccc(Cl)s2)ccc1-n1c(=O)[nH]c2cc(NCc3ccc(F)cc3)ccc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.49
P2RY12 Q9H244 1/20 0.46
KMT2A Q03164 8/20 0.46
MEN1 O00255 7/20 0.46
SMN1; SMN2 Q16637 3/20 0.40
TP53 P04637 2/20 0.40
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
RXFP1 Q9HBX9 2/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL4412345 0.91 P2RY12 (0.49) USP2P2RY12KMT2AMEN1SMN1; SMN2
SCHEMBL4418832 0.87 P2RY12 (0.54) USP2P2RY12KMT2AMEN1SMN1; SMN2
SCHEMBL4415214 0.86 P2RY12 (0.49) USP2P2RY12KMT2AMEN1SMN1; SMN2
SCHEMBL4426718 0.85 P2RY12 (0.49) P2RY12KMT2AMEN1SMN1; SMN2TP53
SCHEMBL13635098 0.84 MEN1 (0.53) P2RY12KMT2AMEN1SMN1; SMN2TP53
SCHEMBL4422992 0.84 CACNA1G (0.46) USP2P2RY12TP53MAPTRXFP1
SCHEMBL4425407 0.83 P2RY12 (0.51) USP2P2RY12KMT2AMEN1SMN1; SMN2
SCHEMBL13634873 0.82 P2RY12 (0.52) P2RY12KMT2AMEN1SMN1; SMN2TP53
SCHEMBL4413815 0.81 P2RY12 (0.51) P2RY12KMT2AMEN1SMN1; SMN2TP53
SCHEMBL4415290 0.81 P2RY12 (0.52) P2RY12KMT2AMEN1SMN1; SMN2TP53

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
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
US-7109332-B2 2,4-dioxo-3-quinazolinylaryl sulfonylureas PORTOLA PHARMACEUTICALS, INC. (US) 2006-09-19 US disclosed
US-20050107357-A1 2,4-dioxo-3-quinazolinylaryl sulfonylureas PORTOLA PHARMACEUTICALS, INC. (US) 2005-05-19 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-20050107357-A1 2,4-dioxo-3-quinazolinylaryl sulfonylureas PFKP, DPP3, P2RY13 USP2 1446/4885P2RY12 21/4885KMT2A 3152/4885

“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.