SCHEMBL3024153

SCHEMBL3024153

C=C(C)OC(=O)c1cc(CC)nn1-c1ccc(C(=O)OCC)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.47
▸ TSHR P16473 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ HTT P42858 4/20 0.44
▸ HPGD P15428 2/20 0.44
▸ KMT2A Q03164 4/20 0.42
▸ MAPT P10636 4/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ USP2 O75604 1/20 0.42
▸ HSP90AA1 P07900 1/20 0.42
▸ CACNA1B Q00975 1/20 0.42
▸ APBA1 Q02410 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ GAA P10253 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40

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
SCHEMBL2928086 0.84 ALDH1A1 (0.46) ALDH1A1TSHRSMN1; SMN2HTTHPGD
SCHEMBL2899043 0.78 ALDH1A1 (0.56) ALDH1A1TSHRSMN1; SMN2HTTHPGD
SCHEMBL22896894 0.78 LMNA (0.56) ALDH1A1SMN1; SMN2HPGDKMT2AMAPT
SCHEMBL6421166 0.73 KMT2A (0.56) ALDH1A1HPGDKMT2AMAPTTDP1
SCHEMBL5698655 0.72 MAPT (0.72) ALDH1A1TSHRSMN1; SMN2HTTHPGD
SCHEMBL6415169 0.69 LMNA (0.55) ALDH1A1SMN1; SMN2HPGDKMT2AMAPT
SCHEMBL15869372 0.69 SMN1; SMN2 (0.56) ALDH1A1SMN1; SMN2HTTHPGDKMT2A
SCHEMBL6415533 0.69 LMNA (0.54) ALDH1A1SMN1; SMN2HPGDKMT2AMAPT
SCHEMBL6176728 0.68 PDE4D (0.56) ALDH1A1SMN1; SMN2HTTKMT2AMAPT
SCHEMBL25897470 0.68 POLB (0.62) ALDH1A1HTTHPGDKMT2ATDP1

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-2481736-A1 Kinase inhibitors useful for the treatment of myleoproliferative diseases and other proliferative diseases Deciphera Pharmaceuticals, LLC. (US) 2012-08-01 — — EP disclosed
EP-2148677-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFERATIVE DISEASES AND OTHER PROLIFERATIVE DISEASES Deciphera Pharmaceuticals, LLC. (US) 2010-02-03 — — EP disclosed
US-20080269267-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFIC DISEASES AND OTHER PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2008-10-30 — — US disclosed
WO-2008131276-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFERATIVE DISEASES AND OTHER PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2008-10-30 — — 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-20080269267-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFIC DISEASES AND OTHER PROLIFERATIVE DISEASES BRAF, RET, KIT ALDH1A1 1743/4885TSHR 584/4885SMN1; SMN2 2591/4885

“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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