SCHEMBL5478308

SCHEMBL5478308

C=CC(O)(CC1CCCc2ccccc21)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.41
NR3C1 P04150 2/20 0.41
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
PDPK1 O15530 1/20 0.38
CYP19A1 P11511 1/20 0.38
TBXAS1 P24557 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
SIGMAR1 Q99720 1/20 0.36
IDO1 P14902 1/20 0.36
KDM5A P29375 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
KDM5B Q9UGL1 1/20 0.36

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
SCHEMBL5473120 0.87 TRPV1 (0.46) TRPV1NR3C1MTNR1AMTNR1BPDPK1
SCHEMBL5479519 0.84 NR3C1 (0.44) NR3C1
SCHEMBL5474384 0.77 NR3C1 (0.47) NR3C1SIGMAR1
SCHEMBL5482042 0.77 HTR1A (0.39) MTNR1AMTNR1BPDPK1TAS1R3TAS1R1
SCHEMBL5175490 0.75 KCNH2 (0.33) KDM4C
SCHEMBL5474457 0.73 UGT2B17 (0.46) NR3C1KDM4C
SCHEMBL5476891 0.73 HTR6 (0.44) MTNR1AMTNR1BSIGMAR1KDM4C
SCHEMBL5613177 0.72 HTR1A (0.49) CYP19A1TBXAS1SIGMAR1IDO1
SCHEMBL5477212 0.71 NR3C1 (0.46) NR3C1
SCHEMBL5471889 0.71 TRPV1 (0.45) TRPV1MTNR1AMTNR1BPDPK1CYP19A1

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-20070129358-A1 Sbstituted chroman derivatives, processes for their preparation and their use as antiinflammatory agents SCHERING AG (DE) 2007-06-07 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-20070129358-A1 Sbstituted chroman derivatives, processes for their preparation and their use as antiinflammatory agents TNF, CXCL8, MPO TRPV1 1347/4885NR3C1 83/4885MTNR1A 2122/4885

“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.