SCHEMBL22100299

SCHEMBL22100299

CC(C)(Sc1ccc(CCN(CCCCCCC2CCCCC2)C(=O)NC2CCCCC2)cc1)C(=O)O

nearest known ligand 0.98

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 15/20 0.98
PPARG P37231 13/20 0.98
PPARD Q03181 6/20 0.98
GMNN O75496 1/20 0.98
USP2 O75604 1/20 0.98
USP1 O94782 1/20 0.98
ALDH1A1 P00352 1/20 0.98
LMNA P02545 1/20 0.98
TP53 P04637 1/20 0.98
CYP1A2 P05177 1/20 0.98
POLB P06746 1/20 0.98
CYP3A4 P08684 1/20 0.98
CYP2D6 P10635 1/20 0.98
MAPT P10636 1/20 0.98
CYP2C9 P11712 1/20 0.98
ALOX15 P16050 1/20 0.98
NFKB1 P19838 1/20 0.98
MAPK1 P28482 1/20 0.98
CYP2C19 P33261 1/20 0.98
BRCA1 P38398 1/20 0.98

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
Gw7647 SCHEMBL361372 0.99 PPARA (1.00) PPARAPPARGPPARDGMNNUSP2
SCHEMBL6552622 0.88 PPARA (0.80) PPARAPPARGPPARDGMNNUSP2
SCHEMBL4265257 0.86 PPARA (1.00) PPARAPPARGPPARDGMNNUSP2
SCHEMBL16147204 0.83 PPARA (1.00) PPARAPPARGPPARDGMNNUSP2
SCHEMBL6552333 0.82 PPARA (0.73) PPARAPPARGPPARDGMNNUSP2
SCHEMBL16147851 0.81 PPARA (1.00) PPARAPPARGPPARDGMNNUSP2
SCHEMBL16147225 0.80 PPARA (1.00) PPARAPPARGPPARDGMNNUSP2
SCHEMBL12274271 0.79 PPARA (0.67) PPARAPPARGPPARDGMNNUSP2
SCHEMBL21123888 0.79 PPARA (0.67) PPARAPPARGPPARDGMNNUSP2
SCHEMBL3675079 0.78 PPARA (0.65) PPARAPPARGPPARDGMNNUSP2

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-11420934-B2 PPAR agonists THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2022-08-23 US disclosed
US-20200190019-A1 PPAR AGONISTS SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2020-06-18 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 (2 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-11420934-B2 PPAR agonists PPARG, PPARD, PPARA PPARA 3/4885PPARG 1/4885PPARD 2/4885
US-20200190019-A1 PPAR AGONISTS PPARG, PPARD, PPARA PPARA 3/4885PPARG 1/4885PPARD 2/4885

“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.