SCHEMBL23864310

SCHEMBL23864310

C=C(C)c1c(F)cccc1-c1ccc(CCCC)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 2/20 0.43
▸ RARB P10826 4/20 0.42
▸ PLK3 Q9H4B4 1/20 0.41
▸ RARA P10276 1/20 0.39
▸ RARG P13631 1/20 0.39
▸ PCSK9 Q8NBP7 1/20 0.38
▸ HDAC3 O15379 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ THRA P10827 2/20 0.38
▸ THRB P10828 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ MAPKAPK2 P49137 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL23864630 0.81 RARB (0.42) PLK1RARBPLK3RARARARG
SCHEMBL9493595 0.79 HDAC3 (0.52) RARBRARARARGHDAC3HDAC1
SCHEMBL27999446 0.79 GRIA4 (0.51) RARBRARARARGALDH1A1MEN1
SCHEMBL9492798 0.78 HDAC3 (0.51) RARBRARARARGHDAC3HDAC1
SCHEMBL28400028 0.77 ALDH1A1 (0.49) RARBRARARARGALDH1A1MEN1
SCHEMBL29287569 0.76 CA1 (0.49) PLK1RARBRARARARGHDAC3
SCHEMBL23864237 0.76 POLB (0.45) PLK1PLK3PCSK9ALDH1A1THRA
SCHEMBL20343303 0.75 HDAC3 (0.49) RARBRARARARGHDAC3HDAC1
SCHEMBL23864288 0.75 PLK1 (0.49) PLK1RARBRARAALDH1A1MEN1
SCHEMBL7786808 0.75 HDAC3 (0.51) PLK1RARBRARARARGHDAC3

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-2968330-B1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS SCRIPPS RESEARCH INST (US) 2021-09-29 — — EP disclosed
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