SCHEMBL278259

SCHEMBL278259

CC(C)NC1CCCCNC1=O

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 12/20 0.54
HTT P42858 1/20 0.51
RAB9A P51151 2/20 0.48
MMP1 P03956 3/20 0.47
MMP3 P08254 2/20 0.47
MMP2 P08253 1/20 0.46
MMP7 P09237 1/20 0.46
MMP8 P22894 1/20 0.46
NPC1 O15118 1/20 0.44

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
SCHEMBL25589865 0.94 CCR2 (0.47) CCR2HTTRAB9AMMP1MMP3
SCHEMBL21843787 0.94 CCR2 (0.47) CCR2HTTRAB9AMMP1MMP3
SCHEMBL25589896 0.94 CCR2 (0.47) CCR2HTTRAB9AMMP1MMP3
SCHEMBL9963367 0.88 CCR2 (0.41) CCR2HTTRAB9AMMP1MMP3
SCHEMBL14703898 0.84 HTT (0.52) CCR2HTTMMP1MMP3MMP2
SCHEMBL3008085 0.80 CCR2 (0.53) CCR2HTTRAB9AMMP1MMP3
SCHEMBL8358035 0.80 CCR2 (0.53) CCR2HTTRAB9AMMP1MMP3
SCHEMBL2778896 0.80 CCR2 (0.53) CCR2HTTRAB9AMMP1MMP3
SCHEMBL8459922 0.80 CCR2 (0.57) CCR2HTTRAB9ANPC1
SCHEMBL327869 0.80 CCR2 (0.57) CCR2HTTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9416111-B2 Substituted diazine and triazine spleen tyrosine kinease (Syk) inhibitors MERCK SHARP & DOHME CORP. (US) 2016-08-16 US disclosed
US-20150166486-A1 SUBSTITUTED DIAZINE AND TRIAZINE SPLEEN TYROSINE KINEASE (SYK) INHIBITORS MERCK SHARP & DOHME LLC 2015-06-18 US disclosed
US-20130040933-A1 AZAINDOLES AS JANUS KINASE INHIBITORS CASH BRANDON (US) 2013-02-14 US disclosed
US-20120115876-A1 N-BENZYL-4-METHYLENEAMINO-3-HYDROXY-2-PYRIDONES WARSHAKOON NAMAL CHITHRANGA (US) 2012-05-10 US disclosed
US-8133894-B2 N-benzyl-4-methyleneamino-3-hydroxy-2-pyridones AKEBIA THERAPEUTICS INC. (US) 2012-03-13 US disclosed
US-20100305097-A1 N-BENZYL-4-METHYLENEAMINO-3-HYDROXY-2-PYRIDONES WARNER CHILCOTT COMPANY, LLC 2010-12-02 US disclosed
US-7790748-B2 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones WARNER CHILCOTT COMPANY, LLC (US) 2010-09-07 US disclosed
US-20070270407-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY 2007-11-22 US disclosed
US-7247648-B2 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY (US) 2007-07-24 US disclosed
US-20040097560-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY 2004-05-20 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 (6 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-20120115876-A1 N-BENZYL-4-METHYLENEAMINO-3-HYDROXY-2-PYRIDONES IL17A, IFNG, CD4 CCR2 451/4885HTT 4198/4885RAB9A 2496/4885
US-20040097560-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones IL17A, CYP51A1, CD4 CCR2 483/4885HTT 4317/4885RAB9A 2641/4885
US-20070270407-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones IL17A, IFNG, CD4 CCR2 452/4885HTT 3971/4885RAB9A 2717/4885
US-20100305097-A1 N-BENZYL-4-METHYLENEAMINO-3-HYDROXY-2-PYRIDONES IL17A, IFNG, CD4 CCR2 451/4885HTT 4198/4885RAB9A 2496/4885
US-20130040933-A1 AZAINDOLES AS JANUS KINASE INHIBITORS JAK1, JAK3, JAK2 CCR2 3479/4885HTT 2241/4885RAB9A 2835/4885
US-20150166486-A1 SUBSTITUTED DIAZINE AND TRIAZINE SPLEEN TYROSINE KINEASE (SYK) INHIBITORS SYK, ZAP70, TYRO3 CCR2 519/4885HTT 3281/4885RAB9A 3346/4885

“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.