SCHEMBL4185231

SCHEMBL4185231

CCc1ccc(-c2ccc(-c3ccc(C(=O)C(C)(C)N4CCOCC4)cc3)c(F)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ MAPK1 P28482 3/20 0.48
▸ TSHR P16473 1/20 0.48
▸ CD274 Q9NZQ7 1/20 0.40
▸ RARB P10826 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39
▸ FKBP1A P62942 1/20 0.39
▸ LMNA P02545 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ALOX5AP P20292 3/20 0.38
▸ FEN1 P39748 3/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ MCHR1 Q99705 1/20 0.37
▸ ERN1 O75460 1/20 0.37
▸ APC P25054 1/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ POLB P06746 1/20 0.35
▸ CTDSP1 Q9GZU7 1/20 0.35

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
SCHEMBL12437027 0.89 RARB (0.55) SMN1; SMN2ALDH1A1MAPK1TSHRRARB
SCHEMBL2913907 0.89 RARB (0.55) SMN1; SMN2ALDH1A1MAPK1TSHRRARB
SCHEMBL16810689 0.88 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1MAPK1TSHRCD274
SCHEMBL2918327 0.88 ALDH1A1 (0.60) SMN1; SMN2ALDH1A1MAPK1TSHRHRH3
SCHEMBL2914899 0.82 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1MAPK1TSHRCD274
SCHEMBL2914565 0.77 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1MAPK1TSHRHRH3
SCHEMBL306032 0.76 ALDH1A1 (0.65) SMN1; SMN2ALDH1A1MAPK1TSHRHRH3
SCHEMBL2917604 0.75 ALDH1A1 (0.63) SMN1; SMN2ALDH1A1MAPK1TSHRHRH3
SCHEMBL13657327 0.74 THRA (0.58) SMN1; SMN2ALDH1A1MAPK1TSHRRARB
SCHEMBL8070009 0.74 ALDH1A1 (0.62) SMN1; SMN2ALDH1A1MAPK1TSHRHRH3

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
WO-2009125021-A1 STRUCTURED FILMS WITH A CONTROLLED TILTED MOLECULAR ORIENTATION AND SHAPE USING A DICHROIC PHOTOINITIATOR STICHTING DUTCH POLYMER INSTITUTE (NL) 2009-10-15 — — WO disclosed
EP-2108691-A1 Structured films with a controlled tilted molecular orientation and shape using a dichroic photoinitiator. Stichting Dutch Polymer Institute (NL) 2009-10-14 — — EP disclosed
WO-2006059895-A1 SWITCHABLE NARROW BAND REFLECTORS PRODUCED IN A SINGLE CURING STEP STICHTING DUTCH POLYMER INSTITUTE (NL) 2006-06-08 — — WO disclosed
Send feedback