SCHEMBL3689702

SCHEMBL3689702

O=C(O)CCc1ccc(CCCNCCCS(=O)(=O)c2ccc(F)cc2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.41
S1PR1 P21453 4/20 0.40
S1PR3 Q99500 2/20 0.40
FFAR4 Q5NUL3 5/20 0.40
RAB9A P51151 2/20 0.39
POLB P06746 1/20 0.39
S1PR5 Q9H228 1/20 0.39
TBXA2R P21731 1/20 0.38
NR3C1 P04150 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL3689006 0.77 CMA1 (0.44) FFAR1FFAR4NR3C1
SCHEMBL3689705 0.76 FFAR1 (0.39) FFAR1S1PR1S1PR3FFAR4RAB9A
SCHEMBL3689701 0.72 LMNA (0.45) FFAR1FFAR4NR3C1
SCHEMBL3686574 0.71 FFAR1 (0.56) FFAR1S1PR1S1PR3FFAR4POLB
SCHEMBL5509232 0.70 CHRM2 (0.50) RAB9A
SCHEMBL1980894 0.68 CES2 (0.41) TBXA2R
SCHEMBL2941883 0.68 LMNA (0.52) TBXA2RALDH1A1
SCHEMBL193318 0.68 FFAR1 (0.79) FFAR1FFAR4
SCHEMBL15891020 0.66 S1PR1 (0.81) FFAR1S1PR1S1PR3S1PR5
Hydrochloric Acid SCHEMBL28568409 0.66 FFAR1 (0.76) FFAR1FFAR4

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-7655641-B2 Sulfonamide derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2010-02-02 US disclosed
US-20060217433-A1 Sulfonamide derivatives as ppar modulators ELI LILLY AND COMPANY (US) 2006-09-28 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-20060217433-A1 Sulfonamide derivatives as ppar modulators PPARD, PPARA, PPARG FFAR1 14/4885S1PR1 997/4885S1PR3 950/4885

“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.