SCHEMBL7091140

SCHEMBL7091140

CCCCCCCCCCc1ccc(-c2cnc(-c3ccc(OC(=O)C(C)CCCC(C)C)cc3F)nc2)cc1F

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 4/20 0.37
▸ S1PR1 P21453 1/20 0.35
▸ FAAH O00519 4/20 0.35
▸ PRSS1 P07477 1/20 0.35
▸ ACR P10323 1/20 0.35
▸ RARA P10276 1/20 0.34
▸ RARG P13631 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ PTGS2 P35354 5/20 0.33
▸ CNR2 P34972 3/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL7094260 0.91 RARB (0.46) RARBS1PR1RARARARGMEN1
SCHEMBL7093761 0.89 THRA (0.38) RARBS1PR1FAAHRARA
SCHEMBL7795403 0.86 CYP3A4 (0.35) RARBFAAHPTGS2
SCHEMBL7092881 0.80 THRA (0.41) RARBS1PR1FAAHRARA
SCHEMBL8651883 0.80 S1PR4 (0.36) RARBS1PR1FAAHRARA
SCHEMBL8651886 0.80 S1PR4 (0.36) RARBS1PR1FAAHRARA
SCHEMBL7091592 0.77 RARB (0.47) RARBRARAMEN1ALDH1A1KMT2A
SCHEMBL7087926 0.77 RARB (0.47) RARBRARAMEN1ALDH1A1KMT2A
SCHEMBL7093872 0.77 RARB (0.47) RARBRARAMEN1ALDH1A1KMT2A
SCHEMBL7088460 0.77 RARB (0.44) RARBFAAHRARARARGMEN1

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-0739884-B1 Liquid crystal compound and liquid crystal composition containing the same SEMICONDUCTOR ENERGY LAB (JP) 2003-08-13 — — EP disclosed
US-5716542-A Liquid crystal compound and liquid crystal composition containing the same TAKASAGO INTERNATIONAL CORPORATION (JP) 1998-02-10 — — US disclosed
EP-0739884-A2 Liquid crystal compound and liquid crystal composition containing the same Takasago International Corporation (JP) 1996-10-30 — — EP disclosed
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