SCHEMBL2074570

SCHEMBL2074570

C=CCc1ccc[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.42
AURKA O14965 1/20 0.42
AURKB Q96GD4 1/20 0.42
INCENP Q9NQS7 1/20 0.42
GABRA1 P14867 2/20 0.41
GABRB2 P47870 2/20 0.41
GAA P10253 3/20 0.39
MCL1 Q07820 1/20 0.38
NAPRT Q6XQN6 1/20 0.38
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
KDM4E B2RXH2 3/20 0.33
LMNA P02545 2/20 0.33
HTT P42858 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL30952858 0.82 DAO (0.43) DAOAURKAAURKBINCENPGAA
SCHEMBL4277237 0.78 GABRA1 (0.42) GABRA1GABRB2GAAADRA2BADRA2C
SCHEMBL5202931 0.77 AURKA (0.44) DAOAURKAAURKBINCENPGAA
SCHEMBL6641176 0.77
SCHEMBL5691773 0.76 HDAC8 (0.42) GABRA1GABRB2GAAADRA2BADRA2C
SCHEMBL8718496 0.74 GABRA1 (0.48) DAOGABRA1GABRB2GAAKDM4E
SCHEMBL797191 0.74
SCHEMBL5685566 0.74
SCHEMBL16759805 0.73 DAO (0.43) DAOAURKAAURKBINCENPGAA
SCHEMBL1694688 0.72

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9133187-B2 Serine/threonine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2015-09-15 US claimed
EP-2681215-B1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2015-04-22 EP claimed
EP-2681215-A1 SERINE/THREONINE KINASE INHIBITORS Array Biopharma, Inc. (US) 2014-01-08 EP claimed
WO-2013131010-A2 FUNCTION OF CHEMOKINE RECEPTOR CCR8 IN MELANOMA METASTASIS ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2013-09-06 WO claimed
WO-2012118850-A1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2012-09-07 WO claimed
US-20110053969-A1 NOVEL DIAZASIPIROAKANES AND THEIR USE FOR TREATMENT OF CCR8 MEDIATED DISEASES ASTRAZENECA AB (SE) 2011-03-03 US claimed
EP-1869045-A1 NOVEL DIAZASPIROALKANES AND THEIR USE FOR TREATMENT OF CCR8 MEDIATED DISEASES AstraZeneca AB (SE) 2007-12-26 EP claimed
WO-2006107254-A1 NOVEL DIAZASPIROALKANES AND THEIR USE FOR TREATMENT OF CCR8 MEDIATED DISEASES ASTRAZENECA AB (SE) 2006-10-12 WO claimed
US-6599942-B1 Method of lowering LDL cholesterol and Lipoprotein a levels in mammals using such compounds NOVARTIS AG (CH) 2003-07-29 US claimed
JP-2002540189-A 2002-11-26 JP claimed
US-20020107390-A1 Thyromimetic organic compounds KUKKOLA PAIVI J (US) 2002-08-08 US claimed
US-20020045751-A1 Thyromimetic organic compounds NOVARTIS AG (CH) 2002-04-18 US claimed
EP-1165502-A1 DIARYL DERIVATIVES AND THEIR USE AS MEDICAMENTS Novartis AG (CH) 2002-01-02 EP claimed
WO-2000058279-A1 DIARYL DERIVATIVES AND THEIR USE AS MEDICAMENTS NOVARTIS AG (CH) 2000-10-05 WO claimed
CN-117642399-A Pyrrolopyridone derivatives useful for the treatment of cancer 泰治疗有限公司 2024-03-01 CN disclosed
CN-107973748-A Pyridinone azo dispersion dyes and its synthetic method containing sulfonate group or sulfoamido 潘劲松 2018-05-01 CN disclosed
US-9133187-B2 Serine/threonine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2015-09-15 US disclosed
EP-0508215-B1 Process for the preparation of 2-chloro-pyridines BAYER AG (DE) 1996-05-15 EP disclosed
US-5283338-A Process for the preparation of 2-chloropyridines BAYER AKTIENGESELLSCHAFT (DE) 1994-02-01 US disclosed
EP-0508215-A1 Process for the preparation of 2-chloro-pyridines BAYER AG (DE) 1992-10-14 EP 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 (3 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-20110053969-A1 NOVEL DIAZASIPIROAKANES AND THEIR USE FOR TREATMENT OF CCR8 MEDIATED DISEASES CCR8, CCR1, CCR3 DAO 4286/4885AURKA 3417/4885AURKB 2939/4885
US-20020045751-A1 Thyromimetic organic compounds TPO, THRA, LPO DAO 458/4885AURKA 3382/4885AURKB 3839/4885
US-20020107390-A1 Thyromimetic organic compounds TSHR, NR1H3, NR1H2 DAO 527/4885AURKA 3268/4885AURKB 3523/4885

“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.