SCHEMBL19426175

SCHEMBL19426175

CNC(=O)C(NO)c1ccc(O)c(O)c1Cl

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 1/20 0.34
▸ ADRA2A P08913 1/20 0.33
▸ ADRA2B P18089 1/20 0.33
▸ ADRA2C P18825 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ YARS1 P54577 1/20 0.31
▸ ERCC1 P07992 1/20 0.31
▸ ERCC4 Q92889 1/20 0.31

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
SCHEMBL19426106 0.84 YARS1 (0.32) ADRA2AADRA2BADRA2CADRA1AALDH1A1
SCHEMBL19426170 0.81 ADRA2A (0.49) ADRA2AADRA2BADRA2CADRA1AYARS1
SCHEMBL19426176 0.78 KMT2A (0.33) FFAR2ADRA2AADRA2CADRA1A
SCHEMBL19426169 0.69 CYP1A2 (0.36) FFAR2
SCHEMBL12380944 0.68 GABRA1 (0.46) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL19426172 0.68 ADRA2A (0.46) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL15495186 0.66 SELL (0.41) —
SCHEMBL2760850 0.66 ADRA2A (0.66) ADRA2AADRA2BADRA2CADRA1AALDH1A1
SCHEMBL30557720 0.65 ADRA2A (0.37) ADRA2AADRA2BADRA2CADRA1AERCC1
SCHEMBL11850416 0.65 ADRB2 (0.39) ADRA2AADRA2BADRA2CADRA1A

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 FFAR2 4755/4885ADRA2A 2852/4885ADRA2B 3350/4885

“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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