SCHEMBL15670992

SCHEMBL15670992

O=c1c2c(Cl)c(O)c(O)cc2ncn1CCCl

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TNF P01375 2/20 0.41
HSD17B13 Q7Z5P4 13/20 0.39
MAPT P10636 1/20 0.37
ADORA2B P29275 1/20 0.37
ESR2 Q92731 4/20 0.35
ESR1 P03372 3/20 0.34

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
SCHEMBL15671151 0.93 TNF (0.45) TNFHSD17B13MAPTADORA2BESR2
SCHEMBL15670839 0.80 SYK (0.39) ESR2ESR1
SCHEMBL17193084 0.77 HSD17B13 (0.38) TNFHSD17B13ESR2ESR1
SCHEMBL15671112 0.77 TNF (0.57) TNFMAPTADORA2B
SCHEMBL17191910 0.73 ESR2 (0.36) HSD17B13ESR2ESR1
SCHEMBL17192041 0.71 TNF (0.47) TNFMAPTADORA2B
SCHEMBL15670874 0.68 TNF (0.72) TNFMAPTADORA2B
SCHEMBL17181483 0.66 TNF (0.47) TNF
SCHEMBL17192032 0.65 HDAC6 (0.46) TNFMAPTADORA2B
SCHEMBL874574 0.64 CYP1A2 (0.59) MAPT

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-10174053-B2 2 substituted cephem compounds GLAXO GROUP LIMITED (GB) 2019-01-08 US disclosed
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-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
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 TNF 2990/4885HSD17B13 2401/4885MAPT 1744/4885
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS CEP170, ABL1, CEPT1 TNF 1673/4885HSD17B13 3579/4885MAPT 2852/4885
US-10174053-B2 2 substituted cephem compounds CEP170, CES2, CMBL TNF 2990/4885HSD17B13 2401/4885MAPT 1744/4885

“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.