SCHEMBL11548718

SCHEMBL11548718

CCCCCCCCc1ccc(C(=O)Oc2ccc(-c3ccc(C)cc3)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
RARB P10826 8/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
ALDH1A1 P00352 1/20 0.59
RARA P10276 1/20 0.59
MTOR P42345 1/20 0.59
THRB P10828 8/20 0.54
THRA P10827 6/20 0.54
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
NPC1 O15118 1/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL11552658 1.00 MAPT (0.60) MAPTSMN1; SMN2RARBMEN1KMT2A
SCHEMBL11549224 1.00 MAPT (0.60) MAPTSMN1; SMN2RARBMEN1KMT2A
SCHEMBL11546659 1.00 MAPT (0.60) MAPTSMN1; SMN2RARBMEN1KMT2A
SCHEMBL11551441 1.00 MAPT (0.60) MAPTSMN1; SMN2RARBMEN1KMT2A
SCHEMBL11548346 1.00 MAPT (0.60) MAPTSMN1; SMN2RARBMEN1KMT2A
SCHEMBL11548353 0.99 MAPT (0.61) MAPTSMN1; SMN2RARBMEN1KMT2A
SCHEMBL11547550 0.99 MAPT (0.61) MAPTSMN1; SMN2RARBMEN1KMT2A
SCHEMBL11548728 0.99 MAPT (0.61) MAPTSMN1; SMN2RARBMEN1KMT2A
SCHEMBL12125123 0.96 THRB (0.58) MAPTSMN1; SMN2RARBMEN1KMT2A
SCHEMBL18434843 0.96 THRB (0.58) MAPTSMN1; SMN2RARBMEN1KMT2A

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