SCHEMBL7793989

SCHEMBL7793989

CCCCCCC(F)COc1ccc(-c2ncc(-c3ccc(C(=O)OC(CCCCCC)C(F)(F)F)cc3)cn2)cc1F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 2/20 0.35
▸ THRB P10828 2/20 0.35
▸ S1PR1 P21453 2/20 0.34
▸ S1PR4 O95977 1/20 0.34
▸ S1PR3 Q99500 1/20 0.34
▸ S1PR5 Q9H228 1/20 0.34
▸ PTPN11 Q06124 1/20 0.33
▸ RARB P10826 6/20 0.33
▸ PLA2G2D Q9UNK4 1/20 0.32
▸ PDGFRB P09619 1/20 0.32
▸ PDGFRA P16234 1/20 0.32
▸ TAS1R3 Q7RTX0 1/20 0.32
▸ TAS1R1 Q7RTX1 1/20 0.32
▸ XDH P47989 1/20 0.31
▸ DGAT1 O75907 1/20 0.31
▸ PPARD Q03181 1/20 0.31
▸ RARA P10276 1/20 0.31
▸ RARG P13631 1/20 0.31
▸ PNLIP P16233 1/20 0.30
▸ MGLL Q99685 1/20 0.30

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
SCHEMBL7795427 0.97 THRA (0.35) THRATHRBS1PR1S1PR4S1PR3
SCHEMBL7791057 0.88 MGLL (0.39) THRATHRBS1PR1S1PR4S1PR3
SCHEMBL7791047 0.87 RARB (0.39) THRATHRBRARBPNLIP
SCHEMBL7795406 0.87 RARB (0.39) THRATHRBRARBPNLIP
SCHEMBL7791045 0.86 PTPN11 (0.47) THRATHRBPTPN11RARBXDH
SCHEMBL9062392 0.84 PTPN11 (0.48) THRATHRBS1PR1S1PR4S1PR3
SCHEMBL9062805 0.84 PTPN11 (0.48) THRATHRBS1PR1S1PR4S1PR3
SCHEMBL9062630 0.84 PTPN11 (0.48) THRATHRBS1PR1S1PR4S1PR3
SCHEMBL7785434 0.81 RAB9A (0.42) RARBPNLIP
SCHEMBL9192412 0.79 RARB (0.50) RARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0821050-B1 Optically active compound and antiferroelectric liquid crystal composition containing the same SEMICONDUCTOR ENERGY LAB (JP) 2001-11-28 — — EP disclosed
US-5820782-A LOW THRESHOLD VOLTAGE AND LOW VISCOSITY; PYRIMIDINE-BASED COMPOUND TAKASAGO INTERNATIONAL CORPORATION (JP) 1998-10-13 — — US disclosed
EP-0821050-A1 Optically active compound and antiferroelectric liquid crystal composition containing the same Takasago International Corporation (JP) 1998-01-28 — — EP disclosed
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