SCHEMBL5049366

SCHEMBL5049366

CCN(CC)C[C@H](O)C[O]

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
TSHR P16473 2/20 0.39
NPY1R P25929 1/20 0.39
NPY2R P49146 1/20 0.39
ABCB1 P08183 4/20 0.35
LMNA P02545 2/20 0.34
PLK1 P53350 2/20 0.34
ACHE P22303 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.32
POLB P06746 1/20 0.32
PLA2G1B P04054 1/20 0.31
PLA2G2A P14555 1/20 0.31
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30

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
SCHEMBL5048807 1.00 L3MBTL1 (0.42) L3MBTL1TSHRNPY1RNPY2RABCB1
SCHEMBL2433052 1.00 L3MBTL1 (0.42) L3MBTL1TSHRNPY1RNPY2RABCB1
SCHEMBL1147342 0.83 TSHR (0.44) L3MBTL1TSHRNPY1RNPY2RABCB1
SCHEMBL29696234 0.79 TSHR (0.39) L3MBTL1TSHRNPY1RNPY2RABCB1
SCHEMBL11429 0.78 TSHR (0.41) L3MBTL1TSHRNPY1RNPY2RABCB1
SCHEMBL7582522 0.77
SCHEMBL7351992 0.77 L3MBTL1 (0.53) L3MBTL1TSHRNPY1RNPY2RABCB1
SCHEMBL135129 0.76 LMNA (0.42) L3MBTL1TSHRNPY1RNPY2RABCB1
SCHEMBL5048808 0.76 LMNA (0.42) L3MBTL1TSHRNPY1RNPY2RABCB1
SCHEMBL5049367 0.76 LMNA (0.42) L3MBTL1TSHRNPY1RNPY2RABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492560-B2 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2013-07-23 US disclosed
US-20120197027-A1 Quinazoline Derivatives as Angiogenesis Inhibitors STOKES ELAINE S E (GB) 2012-08-02 US disclosed
US-7371765-B2 Quinoline derivatives having VEGF inhibiting activity ASTRAZENECA AB (SE) 2008-05-13 US disclosed
US-7074800-B1 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2006-07-11 US disclosed
US-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB 2006-01-05 US disclosed
US-6887874-B2 Cinnoline compounds ASTRAZENECA AB (SE) 2005-05-03 US disclosed
US-20030212055-A1 Cinnoline compounds ASTRAZENECA AB (SE) 2003-11-13 US disclosed
US-20030207878-A1 Chemical compounds ASTRAZENECA AB (SE) 2003-11-06 US disclosed
EP-1313726-A1 QUINOLINE DERIVATIVES HAVING VEGF INHIBITING ACTIVITY AstraZeneca AB (SE) 2003-05-28 EP disclosed
EP-1311500-A2 INDOLE, AZAINDOLE AND INDAZOLE DERIVATIVES HAVING VEGF INHIBITING ACTIVITY AstraZeneca AB (SE) 2003-05-21 EP disclosed
EP-1309587-A1 CINNOLINE COMPOUNDS AstraZeneca AB (SE) 2003-05-14 EP disclosed
WO-2002016348-A1 ANTIANGIOGENIC BICYCLIC DERIVATIVES ASTRAZENECA AB (SE) 2002-02-28 WO disclosed
WO-2002012228-A1 CINNOLINE COMPOUNDS ASTRAZENECA AB (SE) 2002-02-14 WO disclosed
WO-2002012226-A1 QUINOLINE DERIVATIVES HAVING VEGF INHIBITING ACTIVITY ASTRAZENECA AB (SE) 2002-02-14 WO disclosed
WO-2002012227-A2 INDOLE, AZAINDOLE AND INDAZOLE DERIVATIVES HAVING VEGF INHIBITING ACTIVITY ASTRAZENECA AB (SE) 2002-02-14 WO disclosed
EP-1154774-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AstraZeneca AB (SE) 2001-11-21 EP disclosed
WO-2000047212-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2000-08-17 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 (4 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-20120197027-A1 Quinazoline Derivatives as Angiogenesis Inhibitors VEGFA, FLT1, KDR L3MBTL1 4868/4885TSHR 3837/4885NPY1R 1312/4885
US-20030207878-A1 Chemical compounds CYP3A7, HTR3C, CNR1 L3MBTL1 4318/4885TSHR 2177/4885NPY1R 558/4885
US-20030212055-A1 Cinnoline compounds VEGFA, PGF, CCR7 L3MBTL1 4225/4885TSHR 2148/4885NPY1R 898/4885
US-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors FLT4, NOS3, FLT1 L3MBTL1 897/4885TSHR 873/4885NPY1R 157/4885

“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.