SCHEMBL9259746

SCHEMBL9259746

O=C(Nc1ccc(F)cc1F)N(CCc1cccc(CCN(C(=O)Nc2ccc(F)cc2F)C2CCCCC2)c1)C1CCCCC1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.66
▸ PPARD Q03181 1/20 0.66
▸ PPARA Q07869 1/20 0.66
▸ HTT P42858 2/20 0.50
▸ POLB P06746 3/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ MAPT P10636 1/20 0.43
▸ AGER Q15109 2/20 0.43
▸ MTNR1A P48039 1/20 0.43
▸ C5AR1 P21730 1/20 0.43
▸ UBE2M P61081 2/20 0.41
▸ DCUN1D1 Q96GG9 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ SLC6A9 P48067 1/20 0.40
▸ SLC6A5 Q9Y345 1/20 0.40

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
SCHEMBL9257865 0.89 PPARG (0.55) PPARGPPARDPPARAHTTPOLB
SCHEMBL9263100 0.89 PPARG (0.55) PPARGPPARDPPARAHTTPOLB
SCHEMBL9260752 0.89 PPARG (0.55) PPARGPPARDPPARAHTTPOLB
SCHEMBL9261512 0.89 PPARG (0.55) PPARGPPARDPPARAHTTPOLB
SCHEMBL9265071 0.88 PPARG (0.54) PPARGPPARDPPARAHTTPOLB
SCHEMBL9260551 0.86 PPARG (0.67) PPARGPPARDPPARAHTTPOLB
SCHEMBL9260457 0.83 PPARG (0.61) PPARGPPARDPPARAHTTPOLB
SCHEMBL9263146 0.83 PPARG (0.61) PPARGPPARDPPARAHTTPOLB
SCHEMBL9260923 0.82 PPARG (0.59) PPARGPPARDPPARAHTTPOLB
SCHEMBL10447010 0.80 PPARG (0.56) PPARGPPARDPPARAHTTPOLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5384425-A Diurea derivatives useful as medicaments and processes for the preparation thereof YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1995-01-24 — — US disclosed
EP-0325397-B1 DIUREA DERIVATIVES USEFUL AS MEDICAMENTS AND PROCESSES FOR THE PREPARATION THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1993-08-18 — — EP disclosed
US-5166429-A Enzyme inhibitors of acylcoenzyme A cholesterol transferase as anticholesterol agents or antideposit agents YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1992-11-24 — — US disclosed
US-5091419-A Anticholesterol agent YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1992-02-25 — — US disclosed
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