SCHEMBL1703719

SCHEMBL1703719

O=C(O)N(Br)c1cccc(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 1/20 0.49
▸ MEN1 O00255 5/20 0.45
▸ KMT2A Q03164 5/20 0.45
▸ MAPT P10636 2/20 0.45
▸ HTT P42858 2/20 0.45
▸ SRD5A2 P31213 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ POLQ O75417 1/20 0.43
▸ CETP P11597 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ MAOB P27338 1/20 0.41
▸ KCNK3 O14649 1/20 0.41
▸ MGLL Q99685 1/20 0.41

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
SCHEMBL6011961 0.85 CES2 (0.47) CES2MEN1KMT2AMAPTHTT
SCHEMBL3034790 0.81 HDAC1 (0.47) CES2MEN1KMT2AHTTTP53
SCHEMBL1847416 0.81 CES2 (0.50) CES2MEN1KMT2AMAPTHTT
SCHEMBL11174926 0.79 TACR1 (0.50) CES2MEN1KMT2AMAPTHTT
SCHEMBL1013242 0.79 CES2 (0.49) CES2MEN1KMT2AMAPTHTT
SCHEMBL2094545 0.79 MEN1 (0.49) CES2MEN1KMT2AMAPTHTT
SCHEMBL1007873 0.79 RXFP1 (0.42) CES2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL23636332 0.77 TP53 (0.48) CES2MEN1KMT2AMAPTHTT
SCHEMBL1704182 0.77 CES2 (0.44) CES2MEN1KMT2ARAB9ACETP
SCHEMBL2094544 0.75 MEN1 (0.47) CES2MEN1KMT2AMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2268618-B1 COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS NOVARTIS AG (CH) 2015-05-27 — — EP disclosed
EP-2558069-A1 BENZONAPTHYRIDINE COMPOSITIONS AND USES THEREOF Novartis AG (CH) 2013-02-20 — — EP disclosed
CN-102762226-A Benzonaphthyridine-containing vaccines NOVARTIS AG 2012-10-31 — — CN disclosed
EP-2512478-A1 HOMOGENEOUS SUSPENSION OF IMMUNOPOTENTIATING COMPOUNDS AND USES THEREOF Novartis AG (CH) 2012-10-24 — — EP disclosed
EP-2440245-A1 BENZONAPHTHYRIDINE-CONTAINING VACCINES Novartis AG (CH) 2012-04-18 — — EP disclosed
WO-2011130379-A1 BENZONAPTHYRIDINE COMPOSITIONS AND USES THEREOF NOVARTIS AG (CH) 2011-10-20 — — WO disclosed
WO-2011084549-A1 HOMOGENEOUS SUSPENSION OF IMMUNOPOTENTIATING COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2011-07-14 — — WO disclosed
CN-102015651-A Compounds and compositions as TLR activity modulators IRM LLC 2011-04-13 — — CN disclosed
WO-2010144734-A1 BENZONAPHTHYRIDINE-CONTAINING VACCINES NOVARTIS AG (CH) 2010-12-16 — — WO disclosed
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