SCHEMBL10907465

SCHEMBL10907465

CCC(Cl)C(C)(Oc1ccccc1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 12/20 0.42
▸ PPARA Q07869 11/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ADRB3 P13945 3/20 0.38
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PPARD Q03181 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
SCHEMBL5822905 0.83 PPARA (0.44) PPARGPPARAMEN1CYP1A2CYP3A4
Acetic Acid SCHEMBL10738328 0.80 PPARA (0.42) PPARGPPARAMEN1CYP1A2CYP3A4
SCHEMBL17746054 0.78 PPARG (0.40) PPARGPPARAATML3MBTL1PPARD
SCHEMBL5821718 0.78 CYP1A2 (0.43) PPARGPPARAMEN1CYP1A2CYP3A4
SCHEMBL4790308 0.76 PPARA (0.39) PPARGPPARAMEN1CYP1A2CYP3A4
SCHEMBL10756296 0.76 POLB (0.41) PPARGPPARAL3MBTL1
SCHEMBL28490551 0.74 CTSK (0.44) PPARGPPARA
SCHEMBL27339696 0.72 PPARA (0.57) PPARGPPARAMEN1CYP1A2CYP3A4
SCHEMBL31488329 0.72 PPARG (0.46) PPARGPPARA
SCHEMBL17746055 0.71 PPARG (0.49) PPARGPPARAMEN1CYP1A2CYP3A4

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-4613330-A Delivery system for desired agents MICHELSON PAUL E 1986-09-23 — — US disclosed
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