SCHEMBL5511713

SCHEMBL5511713

CCOC(=O)NS(=O)(=O)c1ccc(C)s1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 5/20 0.43
ALDH1A1 P00352 4/20 0.41
GAA P10253 3/20 0.41
HSD17B10 Q99714 2/20 0.40
LMNA P02545 1/20 0.40
RECQL P46063 1/20 0.40
P2RY12 Q9H244 1/20 0.39
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL195598 0.85 P2RY12 (0.53) SMN1; SMN2ALDH1A1LMNAP2RY12CYP1A2
SCHEMBL13362646 0.85 SMN1; SMN2 (0.42) L3MBTL1SMN1; SMN2ALDH1A1GAAHSD17B10
SCHEMBL28459125 0.77 CYP2C9 (0.55) SMN1; SMN2ALDH1A1LMNACYP2C9CYP2C19
SCHEMBL2007912 0.73 FBP1 (0.53) SMN1; SMN2ALDH1A1LMNACYP2C9CYP2C19
SCHEMBL4700005 0.72 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1GAAHSD17B10LMNA
SCHEMBL5931062 0.72 LMNA (0.64) SMN1; SMN2ALDH1A1GAAHSD17B10LMNA
SCHEMBL9575785 0.71 LMNA (0.62) SMN1; SMN2ALDH1A1GAAHSD17B10LMNA
SCHEMBL12630271 0.70 KMT2A (0.47) L3MBTL1SMN1; SMN2ALDH1A1GAALMNA
SCHEMBL10165528 0.70 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1GAAHSD17B10LMNA
SCHEMBL11851628 0.70 GAA (0.49) SMN1; SMN2ALDH1A1GAALMNAP2RY12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156620-A1 [4-(6-FLUORO-7-METHYLAMINO-2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL)-PHENYL]-5-CHLORO-THIOPHEN-2-YL-SULFONYLUREA SALTS, FORMS AND METHODS RELATED THERETO PORTOLA PHARMACEUTICALS, INC. (US) 2009-06-18 US disclosed
CN-101031565-A Substituted 2H-1, 3-benzoxazin-4 (3H) -ones PORTOLA PHARM INC (US) 2007-09-05 CN disclosed
EP-1812429-A2 SUBSTITUTED 2H-1,3-BENZOXAZIN-4(3H)-ONES Portola Pharmaceuticals, Inc. (US) 2007-08-01 EP disclosed
US-7205296-B2 Substituted 2H-1,3-benzoxazin-4(3H)-ones PORTOLA PHARMACEUTICALS, INC. (US) 2007-04-17 US disclosed
WO-2006039212-A2 SUBSTITUTED 2H-1,3-BENZOXAZIN-4(3H)-ONES PORTOLA PHARMACEUTICALS, INC. (US) 2006-04-13 WO disclosed
US-20060069093-A1 Substituted 2H-1,3-benzoxazin-4(3H)-ones PORTOLA PHARMACEUTICALS, INC. (US) 2006-03-30 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-20090156620-A1 [4-(6-FLUORO-7-METHYLAMINO-2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL)-PHENYL]-5-CHLORO-THIOPHEN-2-YL-SULFONYLUREA SALTS, FORMS AND METHODS RELATED THERETO P2RY1, P2RY6, P2RY4 L3MBTL1 3849/4885SMN1; SMN2 2387/4885ALDH1A1 712/4885
US-20060069093-A1 Substituted 2H-1,3-benzoxazin-4(3H)-ones TBXAS1, TBXA2R, SERPINC1 L3MBTL1 1259/4885SMN1; SMN2 933/4885ALDH1A1 704/4885

“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.