SCHEMBL8399726

SCHEMBL8399726

CN(CCCOC(=O)OCCCN(C)Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
LMNA P02545 1/20 0.56
ALDH1A1 P00352 2/20 0.56
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.56
ATM Q13315 3/20 0.54
MAPT P10636 2/20 0.54
MAPK1 P28482 2/20 0.54
KDM4E B2RXH2 1/20 0.54
SIGMAR1 Q99720 1/20 0.54
KDM4A O75164 1/20 0.51
KDM4C Q9H3R0 1/20 0.51

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
Hydrochloric Acid SCHEMBL8399866 0.97 SMN1; SMN2 (0.61) L3MBTL1SMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL28145990 0.88 LMNA (0.59) L3MBTL1SMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL28391662 0.86 ALDH1A1 (0.60) L3MBTL1SMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL11196134 0.85 L3MBTL1 (0.55) L3MBTL1SMN1; SMN2LMNAALDH1A1KMT2A
Hydrochloric Acid SCHEMBL28178151 0.85 ALDH1A1 (0.59) L3MBTL1SMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL11846412 0.84 L3MBTL1 (0.54) L3MBTL1SMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL8399549 0.83 HDAC3 (0.54) L3MBTL1SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL28088429 0.83 SMN1; SMN2 (0.56) L3MBTL1SMN1; SMN2LMNAALDH1A1KMT2A
Hydrochloric Acid SCHEMBL8398756 0.82 HDAC3 (0.53) SMN1; SMN2LMNA
SCHEMBL11197064 0.81 MEN1 (0.60) L3MBTL1SMN1; SMN2ALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0748310-B1 DIESTERS OF CARBONIC ACID ENDOWED WITH ANTIVIRAL AND ANTI-INFLAMMATORY ACTIVITY ITALFARMACO SPA (IT) 1999-06-02 EP disclosed
US-5827881-A ADMINISTERING FOR TREATMENT OF VIRAL DISEASES OR AS ANTIINFLAMMATORY AGENTS ITALFARMACO S.P.A. (IT) 1998-10-27 US disclosed
EP-0748310-A1 DIESTERS OF CARBONIC ACID ENDOWED WITH ANTIVIRAL AND ANTI-INFLAMMATORY ACTIVITY ITALFARMACO S.p.A. (IT) 1996-12-18 EP disclosed
WO-1995023128-A1 DIESTERS OF CARBONIC ACID ENDOWED WITH ANTIVIRAL AND ANTI-INFLAMMATORY ACTIVITY ITALFARMACO S.P.A. (IT) 1995-08-31 WO disclosed