SCHEMBL23635420

SCHEMBL23635420

C=C(O)C(=O)Oc1ccc(-c2ccc(CCCCC)cc2F)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 9/20 0.58
▸ THRB P10828 2/20 0.47
▸ RARA P10276 2/20 0.46
▸ RARG P13631 1/20 0.46
▸ FAAH O00519 1/20 0.44
▸ PTGS2 P35354 1/20 0.44
▸ THRA P10827 1/20 0.43
▸ PTPN11 Q06124 1/20 0.41
▸ S1PR1 P21453 3/20 0.41
▸ S1PR3 Q99500 2/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ KMT2A Q03164 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
SCHEMBL23635430 0.92 RARB (0.46) RARBTHRBFAAHPTGS2S1PR1
SCHEMBL15385623 0.91 RARB (0.55) RARBTHRBRARARARGFAAH
SCHEMBL19721983 0.90 RARB (0.54) RARBTHRBRARARARGFAAH
SCHEMBL19721816 0.89 RARB (0.54) RARBTHRBRARARARGFAAH
SCHEMBL10968845 0.88 RARB (0.62) RARBTHRBRARARARGFAAH
SCHEMBL19722548 0.88 RARB (0.52) RARBTHRBRARARARGFAAH
SCHEMBL19722103 0.88 RARB (0.52) RARBTHRBRARARARGFAAH
SCHEMBL19722285 0.87 RARB (0.57) RARBTHRBRARARARGTHRA
SCHEMBL19721838 0.87 RARB (0.51) RARBTHRBRARARARGFAAH
SCHEMBL19721973 0.87 RARB (0.51) RARBTHRBRARARARGFAAH

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-20210214615-A1 LIQUID CRYSTAL DISPLAY DEVICE AND DISPLAY UNIT JNC CORPORATION (JP) 2021-07-15 — — US disclosed
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