SCHEMBL1572008

SCHEMBL1572008

COC(=O)N(c1ccccc1)c1ccccc1CC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 1/20 0.43
▸ PTGIR P43119 1/20 0.41
▸ TDP1 Q9NUW8 2/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ PTGS2 P35354 1/20 0.39
▸ NPSR1 Q6W5P4 3/20 0.39
▸ MMP2 P08253 2/20 0.39
▸ MMP12 P39900 2/20 0.39
▸ MMP8 P22894 1/20 0.39
▸ MMP13 P45452 1/20 0.39
▸ MMP14 P50281 1/20 0.39
▸ MMP16 P51512 1/20 0.39
▸ BCAT2 O15382 1/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ CXCL8 P10145 4/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HPGD P15428 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
SCHEMBL31518126 0.83 AKR1B1 (0.47) AKR1B1TDP1L3MBTL1PTGS2NPSR1
SCHEMBL8893994 0.80 PTPN1 (0.49) TDP1L3MBTL1ATMALDH1A1HPGD
SCHEMBL3276086 0.78 L3MBTL1 (0.61) TDP1L3MBTL1ATMNPSR1KMT2A
SCHEMBL2092803 0.76 L3MBTL1 (0.43) PTGIRTDP1L3MBTL1ATMNPSR1
SCHEMBL12075221 0.75 KDM4E (0.42) AKR1B1L3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL7339780 0.74 NPC1 (0.55) TDP1ATMNPSR1KMT2AMEN1
SCHEMBL2558366 0.73 AKR1B1 (0.55) AKR1B1TDP1PTGS2BCAT2ALDH1A1
SCHEMBL2089007 0.73 PTGIR (0.41) PTGIRTDP1L3MBTL1ATMNPSR1
SCHEMBL2098123 0.72 ESR1 (0.43) PTGIRTDP1L3MBTL1ATMNPSR1
SCHEMBL30500285 0.72 ALDH1A1 (0.46) TDP1L3MBTL1ATMNPSR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2067772-B1 Dibenzo (b,f) azepine intermediates NOVARTIS AG (CH) 2011-04-13 — — EP disclosed
EP-2067772-A2 Dibenzo [b,f] azepine intermediates and their preparation Novartis Ag (CH) 2009-06-10 — — EP disclosed
EP-1265868-B1 Preparation of DIBENZO[B,F]AZEPINE INTERMEDIATES NOVARTIS AG (CH) 2009-04-08 — — EP disclosed
CN-100455572-C Dibenzo(b,f)azepine derivatives NOVARTIS AG (CH) 2009-01-28 — — CN disclosed
US-7112673-B2 Dibenzo [b,f]azepine intermediates NOVARTIS AG (CH) 2006-09-26 — — US disclosed
CN-1244563-C Dibenzo [ b, f ] azepine intermediates NOVARTIS AG (CH) 2006-03-08 — — CN disclosed
CN-1721409-A Dibenzo(b,f)azepine derivatives NOVARTIS AG (CH) 2006-01-18 — — CN disclosed
US-20030032800-A1 Dibenzo(b,f)azepine derivatives and their preparation NOVARTIS PHARMACEUTICALS CORPORATION 2003-02-13 — — US disclosed
CN-1394204-A Dibenzo [ b, f ] azepine intermediates NOVARTIS AG (CH) 2003-01-29 — — CN disclosed
EP-1265868-A2 DIBENZO (B,F) AZEPINE INTERMEDIATES Novartis AG (CH) 2002-12-18 — — EP disclosed
WO-2001056992-A2 DIBENZO (B,F) AZEPINE INTERMEDIATES NOVARTIS AG (CH) 2001-08-09 — — 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-20030032800-A1 Dibenzo(b,f)azepine derivatives and their preparation MAOB, BBOX1, QDPR AKR1B1 759/4885PTGIR 975/4885TDP1 4197/4885

“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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