SCHEMBL7466916

SCHEMBL7466916

NC(=O)OC(=O)NC[C@@H](O)c1cccc(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 11/20 0.48
ADRB1 P08588 9/20 0.48
ADRB2 P07550 6/20 0.48
BCAT2 O15382 1/20 0.47
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
ADRA1B P35368 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ROCK2 O75116 2/20 0.44
ROCK1 Q13464 2/20 0.44
SLC2A1 P11166 1/20 0.44

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
SCHEMBL7474893 1.00 ADRB3 (0.48) ADRB3ADRB1ADRB2BCAT2ADRA1D
SCHEMBL7466075 1.00 ADRB3 (0.48) ADRB3ADRB1ADRB2BCAT2ADRA1D
SCHEMBL7804827 0.84 RAB9A (0.42) ADRB3ADRB1ADRB2ADRA1DCYP1A2
SCHEMBL7467581 0.84 RAB9A (0.42) ADRB3ADRB1ADRB2ADRA1DCYP1A2
SCHEMBL7458742 0.84 RAB9A (0.42) ADRB3ADRB1ADRB2ADRA1DCYP1A2
SCHEMBL7476838 0.83 BCAT2 (0.47) BCAT2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL7460922 0.83 BCAT2 (0.47) BCAT2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL5248171 0.83 BCAT2 (0.68) BCAT2CYP1A2CYP2D6
SCHEMBL4597974 0.80 CTSL (0.47) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL10319930 0.80 CTSL (0.47) ADRB3ADRB1ADRB2ADRA1DADRA1A

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
EP-0907635-B1 HALOGEN SUBSTITUTED CARBAMATE COMPOUNDS FROM 2-PHENYL-1,2-ETHANEDIOL SK CORP (KR) 2002-09-25 EP disclosed
US-20010034365-A1 Halogen substituted carbamate compounds from 2-phenyl-1,2-ethanediol CHOI YONG MOON (US) 2001-10-25 US disclosed
US-6127412-A TREATMENT OF DISORDERS OF THE CENTRAL NERVOUS SYSTEM, ESPECIALLY AS ANTICONVULSANTS, ANTIEPILEPTIC AND NEUROPROTECTIVE AGENTS AND CENTRALLY ACTING MUSCLE RELAXANTS SK CORPORATION (US) 2000-10-03 US disclosed
US-6103759-A COMPRISING PURE ENANTIOMERIC FORMS, AS WELL AS ENANTIOMERIC MIXTURES, OF (2-(2-CHLOROPHENYL)-2-HYDROXYETHYL)OXYCARBOXAMIDE; USEFUL FOR TRATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS SK CORPORATION (US) 2000-08-15 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-20010034365-A1 Halogen substituted carbamate compounds from 2-phenyl-1,2-ethanediol DDT, GRIK2, GABRD ADRB3 1669/4885ADRB1 2339/4885ADRB2 1524/4885

“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.