SCHEMBL11568880

SCHEMBL11568880

COC(=O)C(Oc1ccc(C(C)(C)C)cc1)c1ccc(Oc2ccc(Cl)c3ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 4/20 0.50
FFAR1 O14842 1/20 0.48
TSHR P16473 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
GCGR P47871 4/20 0.38
ADCY6 O43306 2/20 0.38
ADCY3 O60266 2/20 0.38
ADCY9 O60503 2/20 0.38
ADCY5 O95622 2/20 0.38
ADCY8 P40145 2/20 0.38
ADCY7 P51828 2/20 0.38
ADCY2 Q08462 2/20 0.38
ADCY1 Q08828 2/20 0.38
ADCY4 Q8NFM4 2/20 0.38
LMNA P02545 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MEN1 O00255 2/20 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
SCHEMBL11567774 0.89 ESRRA (0.54) ESRRAFFAR1TSHRNPC1RAB9A
SCHEMBL11563649 0.81 ESRRA (0.49) ESRRAFFAR1TSHRNPC1RAB9A
SCHEMBL11568422 0.81 POLB (0.44) NPC1RAB9AGCGRADCY6ADCY3
SCHEMBL11567624 0.81 POLB (0.44) NPC1RAB9AGCGRADCY6ADCY3
SCHEMBL13757731 0.79 KMT2A (0.50) RAB9AGCGRADCY6ADCY3ADCY9
SCHEMBL11565999 0.78 ESRRA (0.58) ESRRAFFAR1TSHRNPC1RAB9A
SCHEMBL11562974 0.76 MAPT (0.56) NPC1RAB9AGCGRADCY6ADCY3
SCHEMBL11563277 0.75 PPARG (0.43) NPC1RAB9AGCGRADCY6ADCY3
SCHEMBL11562897 0.75 CYP2C19 (0.43) FFAR1LMNAALDH1A1HPGDNPSR1
SCHEMBL11568279 0.73 POLB (0.42) NPC1RAB9AGCGRADCY6ADCY3

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-4168385-A LOWERING OF STEROL AND TRIGLYCERIDE SERUM LEVELS AMERICAN CYANAMID COMPANY (US) 1979-09-18 US disclosed
US-4125729-A Hypolipemic α-aryloxy para substituted phenyl acetic acid compounds AMERICAN CYANAMID COMPANY (US) 1978-11-14 US disclosed