SCHEMBL19426110

SCHEMBL19426110

CC(=O)C(NO)c1cc(O)c(O)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB1 P08588 2/20 0.45
▸ ADRB3 P13945 2/20 0.45
▸ ADRB2 P07550 1/20 0.45
▸ ADRA2A P08913 2/20 0.35
▸ ADRA2B P18089 2/20 0.35
▸ ADRA2C P18825 2/20 0.35
▸ LMNA P02545 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ANPEP P15144 1/20 0.33
▸ SHBG P04278 1/20 0.33
▸ MEP1B Q16820 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ XDH P47989 1/20 0.32
▸ GFER P55789 1/20 0.32
▸ NFKB2 Q00653 1/20 0.32
▸ RELA Q04206 1/20 0.32

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
SCHEMBL19426173 0.83 ADRB1 (0.43) ADRB1ADRB3ADRB2ADRA2AADRA2B
SCHEMBL19426112 0.81 CYP1A2 (0.38) LMNAKDM4EPOLBGAANFKB1
SCHEMBL19426174 0.75 TDP1 (0.43) ADRB1ADRB3ADRB2ADRA2AADRA2B
SCHEMBL19426108 0.74 ADRA2A (0.45) ADRB1ADRB3ADRB2ADRA2AADRA2B
SCHEMBL15631292 0.69 GABRA1 (0.61) ADRB1ADRB3ADRB2ADRA2AADRA2B
SCHEMBL19426105 0.68 ADRA2A (0.47) ADRB1ADRB3ADRB2ADRA2AADRA2B
SCHEMBL27487696 0.67 ADRB2 (0.42) ADRB1ADRB3ADRB2ADRA2BLMNA
SCHEMBL19426169 0.66 CYP1A2 (0.36) KMT2A
SCHEMBL19426177 0.65 ADRB1 (0.44) ADRB1ADRB3ADRB2ADRA2AADRA2B
SCHEMBL26672809 0.64 ADRA2A (0.70) ADRB1ADRB3ADRB2ADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2017-10-05 — — 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 (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-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS CEP170, CES2, CMBL ADRB1 3823/4885ADRB3 3990/4885ADRB2 2846/4885

“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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