SCHEMBL9501629

SCHEMBL9501629

O=[N+]([O-])c1ccc(C=Cc2ccc(N3CCC(O)CC3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.57
CTSB P07858 1/20 0.57
MAPT P10636 9/20 0.54
ALDH1A1 P00352 4/20 0.51
SIRT6 Q8N6T7 2/20 0.51
POLB P06746 2/20 0.51
ADRB1 P08588 1/20 0.51
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
LMNA P02545 2/20 0.49
MAPK1 P28482 2/20 0.49
GAA P10253 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HRH3 Q9Y5N1 1/20 0.48

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
SCHEMBL9637438 1.00 CTSL (0.57) CTSLCTSBMAPTALDH1A1SIRT6
SCHEMBL27789 0.91 MAPT (0.64) MAPTALDH1A1SIRT6POLBADRB1
SCHEMBL25205345 0.88 CTSL (0.78) CTSLCTSBMAPTALDH1A1MEN1
SCHEMBL25218086 0.88 CTSL (0.78) CTSLCTSBMAPTALDH1A1MEN1
SCHEMBL6218863 0.85 MAPT (0.66) CTSLCTSBMAPTALDH1A1SIRT6
SCHEMBL9651198 0.83 MAPT (0.77) CTSLCTSBMAPTALDH1A1SIRT6
SCHEMBL8724462 0.82 CTSL (0.53) CTSLCTSBMAPTALDH1A1SIRT6
SCHEMBL8724463 0.82 CTSL (0.53) CTSLCTSBMAPTALDH1A1SIRT6
SCHEMBL9649952 0.82 MAPT (0.81) CTSLCTSBMAPTALDH1A1SIRT6
SCHEMBL854301 0.82 MAPT (0.56) MAPTALDH1A1SIRT6POLBADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0316662-B1 ACRYLIC COPOLYMERS EXHIBITING NONLINEAR OPTICAL RESPONSE HOECHST CELANESE CORPORATION (US) 1993-05-12 EP disclosed
EP-0290061-B1 LINEAR ADDITION POLYMER WITH HYPERPOLARIZABLE SIDE GROUPS Akzo Nobel N.V. (NL) 1992-07-15 EP disclosed
US-5043391-A Linear addition polymer with hyperpolarizable side groups AKZO N.V. (NL) 1991-08-27 US disclosed
US-4999401-A Electro-optical Laminates AKZO N.V. (NL) 1991-03-12 US disclosed
US-4913845-A Organic-inorganic composites with enhanced nonlinear optical response HOECHST CELANESE CORP. (US) 1990-04-03 US disclosed
EP-0334176-A1 Organic-inorganic composites with enhanced nonlinear optical response HOECHST CELANESE CORPORATION (US) 1989-09-27 EP disclosed
US-4867516-A Electro-optically induced optical waveguide, and active devices comprising such a waveguide STAAT DER NEDERLANDEN (NL) 1989-09-19 US disclosed
EP-0316662-A1 Acrylic copolymers exhibiting nonlinear optical response HOECHST CELANESE CORPORATION (US) 1989-05-24 EP disclosed
US-4828758-A COLLOIDAL METAL IN POLYMER MATRIX Hoechst Gelanese Corp. (US) 1989-05-09 US disclosed
US-4801670-A Acrylic copolymers exhibiting nonlinear optical response HOECAST CELANESE CORP. (US) 1989-01-31 US disclosed