SCHEMBL11548841

SCHEMBL11548841

CCCc1ccc(-c2ccc(C(=O)Oc3ccc(C)cc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.58
THRB P10828 3/20 0.58
SMN1; SMN2 Q16637 4/20 0.57
PRSS1 P07477 4/20 0.54
ACR P10323 3/20 0.54
KMT2A Q03164 4/20 0.51
PLA2G1B P04054 1/20 0.51
ATG4B Q9Y4P1 1/20 0.51
TP53 P04637 1/20 0.48
NPC1 O15118 2/20 0.48
CASP3 P42574 1/20 0.48
RAB9A P51151 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
ENPP1 P22413 1/20 0.47
RARB P10826 1/20 0.45
MEN1 O00255 1/20 0.45
F2 P00734 1/20 0.45
PRSS2 P07478 1/20 0.45

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
SCHEMBL16765600 0.95 PRSS1 (0.57) MAPTTHRBSMN1; SMN2PRSS1ACR
SCHEMBL11554757 0.94 MAPT (0.64) MAPTTHRBSMN1; SMN2PRSS1ACR
SCHEMBL11556126 0.94 MAPT (0.64) MAPTTHRBSMN1; SMN2PRSS1ACR
SCHEMBL24805749 0.92 PRSS1 (0.54) MAPTTHRBSMN1; SMN2PRSS1ACR
SCHEMBL11546624 0.92 RARB (0.57) MAPTTHRBSMN1; SMN2PRSS1ACR
SCHEMBL11553650 0.92 RARB (0.57) MAPTTHRBSMN1; SMN2PRSS1ACR
SCHEMBL12736303 0.91 MAPT (0.61) MAPTTHRBSMN1; SMN2PRSS1ACR
SCHEMBL11547550 0.90 MAPT (0.61) MAPTTHRBSMN1; SMN2KMT2ANPC1
SCHEMBL11548353 0.90 MAPT (0.61) MAPTTHRBSMN1; SMN2KMT2ANPC1
SCHEMBL11548728 0.90 MAPT (0.61) MAPTTHRBSMN1; SMN2KMT2ANPC1

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-4136053-A BIPHENYL ESTERS AND LIQUID CRYSTALLINE MIXTURES COMPRISING THEM MERCK PATENT GESELLSCHAFT MIT BESCHANKTER HAFTUNG (DE) 1979-01-23 US disclosed
US-4065489-A Biphenyl esters and liquid crystalline mixtures comprising them MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1977-12-27 US disclosed