SCHEMBL29801700

SCHEMBL29801700

CCCCOc1ccc(CC(CC)C(=O)O)cc1CNC(=O)c1ccc(C(F)(F)F)cc1F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 20/20 1.00
▸ PPARA Q07869 17/20 1.00
▸ PPARG P37231 14/20 1.00

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
SCHEMBL29422569 1.00 PPARD (1.00) PPARDPPARAPPARG
SCHEMBL16553231 1.00 PPARD (1.00) PPARDPPARAPPARG
SCHEMBL22323851 1.00 PPARD (1.00) PPARDPPARAPPARG
SCHEMBL23752211 0.90 PPARA (1.00) PPARDPPARAPPARG
SCHEMBL18644833 0.90 PPARA (1.00) PPARDPPARAPPARG
SCHEMBL6498633 0.82 PPARA (0.86) PPARDPPARAPPARG
SCHEMBL3418675 0.81 PPARA (0.83) PPARDPPARAPPARG
SCHEMBL6496446 0.80 PPARA (0.76) PPARDPPARAPPARG
SCHEMBL3943372 0.77 PPARD (1.00) PPARDPPARAPPARG
SCHEMBL6374864 0.76 PPARA (1.00) PPARDPPARAPPARG

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-20220387393-A1 METHODS FOR THE TREATMENT OF DYSMYELINATING/DEMYELINATING DISEASES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-12-08 — — US disclosed
EP-4031124-A1 USE OF A PPAR-DELTA AGONIST IN THE TREATMENT OF KIDNEY DISEASE Reneo Pharmaceuticals, Inc. (US) 2022-07-27 — — EP disclosed
Send feedback