SCHEMBL17191944

SCHEMBL17191944

CC(C)c1c[nH]c2c(Cl)c(O)c(O)cc2c1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRA1 P14867 2/20 0.36
▸ GABRB1 P18505 1/20 0.36
▸ GABRB2 P47870 1/20 0.34
▸ CSNK2A2 P19784 3/20 0.33
▸ CSNK2B P67870 3/20 0.33
▸ CSNK2A1 P68400 3/20 0.33
▸ PARP14 Q460N5 1/20 0.33
▸ LMNA P02545 2/20 0.33
▸ DAO P14920 2/20 0.31
▸ ADRA1A P35348 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ GRIN2D O15399 1/20 0.30
▸ GRIN3B O60391 1/20 0.30
▸ GRIN1 Q05586 1/20 0.30
▸ GRIN2A Q12879 1/20 0.30
▸ GRIN2B Q13224 1/20 0.30
▸ GRIN2C Q14957 1/20 0.30
▸ GRIN3A Q8TCU5 1/20 0.30

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
SCHEMBL15680211 0.80 CYP3A4 (0.37) CSNK2A2CSNK2BCSNK2A1LMNADAO
SCHEMBL19426126 0.77 CYP1A2 (0.39) CSNK2A2CSNK2BCSNK2A1
SCHEMBL17191942 0.77 GABRA1 (0.36) GABRA1GABRB1GABRB2LMNADAO
SCHEMBL15680292 0.74 CSNK2A2 (0.40) CSNK2A2CSNK2BCSNK2A1LMNAALDH1A1
SCHEMBL19426104 0.73 SRC (0.38) GABRA1GABRB2LMNADAOADRA1A
SCHEMBL17191882 0.72 POLB (0.43) CSNK2A2CSNK2BCSNK2A1
SCHEMBL17191941 0.70 ACHE (0.37) LMNADAOADRA1ATHRATHRB
SCHEMBL4969264 0.66 CSNK2A2 (0.50) CSNK2A2CSNK2BCSNK2A1LMNAALDH1A1
SCHEMBL19418724 0.64 LMNA (0.37) GABRA1GABRB1GABRB2PARP14LMNA
SCHEMBL23682766 0.63 ADRA1A (0.50) GABRA1GABRB1GABRB2LMNADAO

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 4 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

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 GABRA1 3836/4885GABRB1 3329/4885GABRB2 2708/4885
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS CEP170, ABL1, CEPT1 GABRA1 3713/4885GABRB1 3124/4885GABRB2 2610/4885
US-10174053-B2 2 substituted cephem compounds CEP170, CES2, CMBL GABRA1 3836/4885GABRB1 3329/4885GABRB2 2708/4885

“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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