SCHEMBL15670882

SCHEMBL15670882

COc1ccc(COc2cc3ncn(C)c(=O)c3c(Cl)c2OCc2ccc(OC)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 7/20 0.42
TNF P01375 1/20 0.41
PLK1 P53350 2/20 0.41
CSF1R P07333 1/20 0.41
NPBWR1 P48145 1/20 0.37
CYP3A4 P08684 2/20 0.37
KDM4E B2RXH2 2/20 0.37
LMNA P02545 2/20 0.37
POLB P06746 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL17181483 0.88 TNF (0.47) TNFPLK1CSF1RNPBWR1KDM4E
SCHEMBL17181536 0.87 TNF (0.51) TNFPLK1CSF1RNPBWR1KDM4E
SCHEMBL15680515 0.84 SYK (0.41) SYKPLK1CSF1RNPC1RAB9A
SCHEMBL17192040 0.83 KDM4E (0.46) TNFCSF1RKDM4EALDH1A1MEN1
SCHEMBL15671101 0.82 TNF (0.47) TNFCSF1RKDM4EALDH1A1MEN1
SCHEMBL17181555 0.80 TNF (0.39) TNFPLK1CSF1RCYP3A4KDM4E
SCHEMBL21187343 0.80 SYK (0.43) SYKPLK1CSF1RKDM4ENPC1
SCHEMBL10324086 0.79 SYK (0.48) SYKCYP3A4NPC1RAB9A
SCHEMBL17181429 0.79 TNF (0.38) TNFPLK1CSF1RNPC1RAB9A
SCHEMBL17181367 0.77 TNF (0.57) SYKTNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10174053-B2 2 substituted cephem compounds GLAXO GROUP LIMITED (GB) 2019-01-08 US disclosed
US-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2017-10-05 US disclosed
US-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2017-10-05 US disclosed
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LTD (GB) 2015-10-22 US disclosed
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LTD (GB) 2015-10-22 US disclosed
EP-2917223-A1 2 SUBSTITUTED CEPHEM COMPOUNDS Glaxo Group Limited (GB) 2015-09-16 EP disclosed
WO-2014068388-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2014-05-08 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 (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-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS CEP170, CES2, CMBL SYK 3240/4885TNF 2990/4885PLK1 2169/4885
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS CEP170, ABL1, CEPT1 SYK 221/4885TNF 1673/4885PLK1 3051/4885
US-10174053-B2 2 substituted cephem compounds CEP170, CES2, CMBL SYK 3240/4885TNF 2990/4885PLK1 2169/4885

“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.