SCHEMBL5016528

SCHEMBL5016528

COC(=O)c1ccc(OC)c2[nH]c3c(Cl)cccc3c12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 4/20 0.54
GAA P10253 3/20 0.45
GLA P06280 1/20 0.45
DYRK1A Q13627 7/20 0.45
CDK9 P50750 5/20 0.45
DYRK1B Q9Y463 4/20 0.44
DYRK2 Q92630 3/20 0.44
HPGD P15428 3/20 0.44
LMNA P02545 2/20 0.44
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43

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
SCHEMBL5016443 0.80 MEN1 (0.56) NR4A2GAAGLAHPGDLMNA
SCHEMBL11737951 0.75 PBRM1 (0.52) GAADYRK1ACDK9DYRK1BDYRK2
SCHEMBL17249871 0.71 NR4A2 (0.53) NR4A2LMNAKDM4EMAPTMEN1
SCHEMBL2040417 0.71 NR4A2 (1.00) NR4A2HPGDLMNAKDM4EMAPT
SCHEMBL5016529 0.70 DYRK1A (0.51) NR4A2DYRK1ACDK9DYRK1BDYRK2
SCHEMBL28074412 0.70 KDM4E (0.56) GAAGLADYRK1ACDK9DYRK1B
SCHEMBL51079 0.69 GAA (0.61) GAAGLAHPGDLMNAKDM4E
SCHEMBL8322794 0.69 KDM4E (0.57) NR4A2GAAGLAHPGDKDM4E
SCHEMBL5022210 0.68 PIM1 (0.47) NR4A2GAAHPGDLMNAKDM4E
SCHEMBL9936554 0.68 NR4A2 (0.70) NR4A2GAAGLADYRK1AHPGD

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
US-20080146810-A1 NOVEL TRICYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS S.A. (CH) 2008-06-19 US disclosed
EP-1554262-B1 NOVEL TRICYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LTD (IN) 2007-12-05 EP disclosed
US-7238725-B2 Tricyclic compounds useful for the treatment of inflammatory and allergic disorders: process for their preparation and pharmaceutical compositions containing them GLENMARK PHARMACEUTICALS LTD. (IN) 2007-07-03 US disclosed
US-20060178418-A1 Novel tricyclic compounds useful for the treatment of inflammatory and allergic disorders:process for their preparation and pharmaceutical compositions containing them GLENMARK PHARMACEUTICALS LTD. (IN) 2006-08-10 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-20080146810-A1 NOVEL TRICYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LTC4S, TSLP, GPR119 NR4A2 547/4885GAA 681/4885GLA 1798/4885
US-20060178418-A1 Novel tricyclic compounds useful for the treatment of inflammatory and allergic disorders:process for their preparation and pharmaceutical compositions containing them LTC4S, TSLP, GPR119 NR4A2 547/4885GAA 681/4885GLA 1798/4885

“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.