SCHEMBL1998092

SCHEMBL1998092

CC1(OC(=O)C(F)(F)F)NCCOc2ccc3c(c(Cl)cn3S(=O)(=O)c3cccc(F)c3)c21

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 16/20 0.42
PKM P14618 2/20 0.40
PKLR P30613 2/20 0.40
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HTR2C P28335 1/20 0.38
USP9X Q93008 1/20 0.35

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
SCHEMBL1997381 0.92 HTR6 (0.40) HTR6PKMPKLRSMN1; SMN2HTR2C
SCHEMBL1998909 0.87 HTR6 (0.38) HTR6PKMPKLRHTR2C
SCHEMBL1996682 0.85 PKM (0.40) HTR6PKMPKLRHTTSMN1; SMN2
Trifluoroacetic Acid SCHEMBL1998089 0.77 HTR6 (0.39) HTR6PKMPKLRHTTSMN1; SMN2
SCHEMBL1994437 0.74 HTR6 (0.46) HTR6HTTNPSR1HTR2C
SCHEMBL2001918 0.74 PKM (0.44) HTR6PKMPKLRHTTSMN1; SMN2
Trifluoroacetic Acid SCHEMBL1996681 0.72 PKM (0.41) HTR6PKMPKLRHTTSMN1; SMN2
SCHEMBL1995457 0.71 PKM (0.37) HTR6PKMPKLRHTR2C
SCHEMBL1998227 0.69 HTR6 (0.36) HTR6PKMPKLRHTR2C
SCHEMBL1992945 0.69 HTR6 (0.37) HTR6PKMPKLRHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960374-B2 e.g. 2,5-methylene-9-(phenylsulfonyl)-1,2,3,4,5,9-hexahydro[1,5]oxazocino[3,2-e]indole; serotonin receptors antagonist or partial agonist; metabolic diseases, e.g. obesity, insulin resisitance, type 2 diabetes, eating disorders; antidepressant, anxiolytic agent; cosmetics PROXIMAGEN LIMITED (GB) 2011-06-14 US disclosed
US-20080176829-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-07-24 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-20080176829-A1 Compounds HTR6, HTR1B, HTR1A HTR6 1/4885PKM 1287/4885PKLR 2231/4885

“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.