SCHEMBL12716756

SCHEMBL12716756

CCCC(O)C1CCC(c2ccc(/C=C/C3CCC(c4ccc(OCC)c(F)c4)CC3)c(F)c2F)CC1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 2/20 0.36

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
SCHEMBL13586100 0.91 — —
SCHEMBL12718228 0.91 — —
SCHEMBL12716495 0.91 KDM1A (0.38) KDM1A
SCHEMBL12822562 0.90 — —
SCHEMBL12821192 0.88 — —
SCHEMBL13586205 0.87 TUBB1 (0.37) KDM1A
SCHEMBL12734091 0.86 KDM1A (0.41) KDM1A
SCHEMBL12734092 0.86 KDM1A (0.41) KDM1A
SCHEMBL12821248 0.85 — —
SCHEMBL13586443 0.85 FFAR1 (0.30) —

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
EP-2305627-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT Chisso Corporation (JP) 2011-04-06 — — EP disclosed
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