SCHEMBL6560622

SCHEMBL6560622

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3(O)CCC4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ INPP5D Q92835 2/20 0.62
▸ USP2 O75604 4/20 0.58
▸ MEN1 O00255 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ ALOX15 P16050 1/20 0.54
▸ PLA2G1B P04054 1/20 0.52
▸ CDC25A P30304 5/20 0.51
▸ CDC25B P30305 5/20 0.51
▸ CYP8B1 Q9UNU6 1/20 0.51
▸ NPC1L1 Q9UHC9 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ TP53 P04637 1/20 0.48
▸ OSBP P22059 1/20 0.47
▸ OSBP2 Q969R2 1/20 0.47
▸ GPBAR1 Q8TDU6 2/20 0.47
▸ NR1H4 Q96RI1 1/20 0.47
▸ ST6GAL1 P15907 1/20 0.46
▸ CYP2D6 P10635 1/20 0.45

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
SCHEMBL6560618 1.00 INPP5D (0.62) INPP5DUSP2MEN1KMT2AALDH1A1
SCHEMBL18541413 0.92 INPP5D (0.73) INPP5DUSP2MEN1KMT2AALDH1A1
SCHEMBL24103972 0.88 INPP5D (0.64) INPP5DUSP2MEN1KMT2AALDH1A1
SCHEMBL16226138 0.87 USP2 (0.59) INPP5DUSP2MAPTLMNATP53
SCHEMBL7127648 0.85 INPP5D (0.55) INPP5DUSP2MEN1KMT2AALDH1A1
SCHEMBL7127645 0.85 INPP5D (0.55) INPP5DUSP2MEN1KMT2AALDH1A1
SCHEMBL17975508 0.85 INPP5D (0.58) INPP5DUSP2MEN1KMT2AALDH1A1
SCHEMBL4247041 0.81 PLA2G1B (0.60) INPP5DUSP2MEN1KMT2AALDH1A1
SCHEMBL16226832 0.78 INPP5D (0.57) INPP5DUSP2MEN1KMT2AALDH1A1
SCHEMBL18541414 0.78 INPP5D (0.98) INPP5DUSP2MEN1KMT2AALDH1A1

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-0735403-B1 Liquid crystal orienting agent JSR CORP (JP) 2004-03-17 — — EP disclosed
US-5700860-A Liquid crystal orienting agent JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1997-12-23 — — US disclosed
EP-0735403-A1 Liquid crystal orienting agent JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1996-10-02 — — EP disclosed
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