SCHEMBL20032516

SCHEMBL20032516

CCC(=O)O/N=C(\C)C(=O)c1ccc2c(c1)C(CC)(CC)c1ccccc1-2

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 14/20 0.38
▸ HTR7 P34969 3/20 0.34
▸ HTR2B P41595 3/20 0.34
▸ KMT2A Q03164 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ APEX1 P27695 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
SCHEMBL18235845 1.00 PDK2 (0.38) PDK2HTR7HTR2BKMT2AL3MBTL1
SCHEMBL18235862 0.91 PDK2 (0.36) PDK2HTR7HTR2BKMT2AL3MBTL1
SCHEMBL18235843 0.91 PDK2 (0.39) PDK2HTR7HTR2BKMT2AL3MBTL1
SCHEMBL18222911 0.91 PDK2 (0.39) PDK2HTR7HTR2BKMT2AL3MBTL1
SCHEMBL20032518 0.91 PDK2 (0.39) PDK2HTR7HTR2BKMT2AL3MBTL1
SCHEMBL20032407 0.90 PDK2 (0.38) PDK2HTR7HTR2BKMT2AL3MBTL1
SCHEMBL18235857 0.89 PDK2 (0.37) PDK2HTR7HTR2BAPEX1
SCHEMBL18235846 0.89 PDK2 (0.37) PDK2KMT2AL3MBTL1
SCHEMBL18235851 0.88 KMT2A (0.39) PDK2KMT2AL3MBTL1
SCHEMBL28162990 0.88 KMT2A (0.42) PDK2KMT2AL3MBTL1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11820932-B2 Polymerisable liquid crystal material and polymerised liquid crystal film MERCK PATENT GMBH (DE) 2023-11-21 — — US disclosed
US-11820932-B2 Polymerisable liquid crystal material and polymerised liquid crystal film MERCK PATENT GMBH (DE) 2023-11-21 — — US disclosed
EP-3668948-B1 POLYMERISABLE LIQUID CRYSTAL MATERIAL AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2023-10-25 — — EP disclosed
EP-3519533-B1 POLYMERISABLE LIQUID CRYSTAL MATERIAL AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2020-12-16 — — EP disclosed
US-20200199453-A1 POLYMERISABLE LIQUID CRYSTAL MATERIAL AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2020-06-25 — — US disclosed
US-20190218459-A1 POLYMERISABLE LIQUID CRYSTAL MATERIAL AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2019-07-18 — — US disclosed
WO-2019034590-A1 POLYMERISABLE LIQUID CRYSTAL MATERIAL AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2019-02-21 — — WO disclosed
WO-2018060110-A1 POLYMERISABLE LIQUID CRYSTAL MATERIAL AND POLYMERISED LIQUID CRYSTAL FILM MERCK PATENT GMBH (DE) 2018-04-05 — — WO disclosed
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