SCHEMBL5484793

SCHEMBL5484793

Cc1ccc2c(c1)OCCC2CC(O)(C=O)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD17B2 P37059 2/20 0.40
KDM4C Q9H3R0 14/20 0.37
KDM6B O15054 6/20 0.37
FFAR1 O14842 2/20 0.34
PPARG P37231 2/20 0.34
PPARD Q03181 2/20 0.34
HSD17B1 P14061 1/20 0.32
HTR1A P08908 1/20 0.32

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
SCHEMBL5173373 0.91 KDM4C (0.43) HSD17B2KDM4CKDM6BHTR1A
SCHEMBL5477197 0.88 HSD17B2 (0.38) HSD17B2KDM4CKDM6BHSD17B1
SCHEMBL5475424 0.85 HTR1A (0.48) KDM4CKDM6BFFAR1PPARGPPARD
SCHEMBL5175753 0.83 PTGDR2 (0.35) KDM4C
SCHEMBL5474864 0.80 PTGDR2 (0.35) KDM4C
SCHEMBL5477176 0.79 KDM4C (0.41) HSD17B2KDM4CHTR1A
SCHEMBL5476386 0.79 HTR1A (0.48) HTR1A
SCHEMBL5471302 0.76 KDM4C (0.40) HSD17B2KDM4CKDM6BFFAR1PPARG
SCHEMBL5930715 0.75 ADRA2A (0.38) HTR1A
SCHEMBL14567198 0.75 PPARD (0.53) KDM4CKDM6BFFAR1PPARGPPARD

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
CN-101160305-A Substituted chroman derivatives, method for the production and the use thereof in the form of antiphlogistics SCHERING AG (DE) 2008-04-09 CN disclosed
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 HSD17B2 1154/4885KDM4C 3261/4885KDM6B 3417/4885

“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.