SCHEMBL3064368

SCHEMBL3064368

CC/C(=C\c1ccc(OC)c(OCc2ccccc2)c1)[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
HPGD P15428 4/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
AMY1A P0DUB6 1/20 0.52
MAPT P10636 8/20 0.51
SMN1; SMN2 Q16637 6/20 0.51
LMNA P02545 5/20 0.51
RAB9A P51151 4/20 0.51
NPSR1 Q6W5P4 3/20 0.51
MAPK1 P28482 2/20 0.51
NTSR1 P30989 1/20 0.51
S1PR4 O95977 1/20 0.51
S1PR1 P21453 1/20 0.51
GPR35 Q9HC97 1/20 0.51
APP P05067 4/20 0.50
KDM4E B2RXH2 4/20 0.49
NPC1 O15118 3/20 0.49
USP2 O75604 1/20 0.49
NSD2 O96028 1/20 0.49
POLB P06746 1/20 0.49

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
SCHEMBL3064370 1.00 ALDH1A1 (0.54) ALDH1A1HPGDL3MBTL1AMY1AMAPT
SCHEMBL21279252 0.92 ALDH1A1 (0.52) ALDH1A1HPGDL3MBTL1AMY1AMAPT
SCHEMBL3064358 0.87 MAPT (0.66) ALDH1A1HPGDL3MBTL1AMY1AMAPT
SCHEMBL3064354 0.87 MAPT (0.66) ALDH1A1HPGDL3MBTL1AMY1AMAPT
SCHEMBL16930248 0.87 LMNA (0.45) ALDH1A1HPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL16930247 0.87 LMNA (0.45) ALDH1A1HPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL27389740 0.85 LMNA (0.43) ALDH1A1HPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL1971750 0.85 VCP (0.55) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL1971749 0.85 VCP (0.55) ALDH1A1HPGDMAPTSMN1; SMN2LMNA
SCHEMBL16929944 0.83 KDM4E (0.50) ALDH1A1HPGDMAPTSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12024521-B2 Isoquinoline derivatives, methods of synthesis and uses thereof PROSETTA BIOSCIENCES, INC. (US) 2024-07-02 US disclosed
WO-2022006228-A1 ISOQUINOLINE DERIVATIVES, METHODS OF SYNTHESIS AND USES THEREOF PROSETTA BIOSCIENCES, INC. (US) 2022-01-06 WO disclosed
EP-3143020-B1 DIHYDROQUINOLIZINONES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN LA ROCHE (CH) 2019-08-21 EP disclosed
US-9949966-B2 Dihydroquinolizinones for the treatment and prophylaxis of hepatitis B virus infection HOFFMAN-LA ROCHE INC. (US) 2018-04-24 US disclosed
EP-3099685-B1 NOVEL DIHYDROQUINOLIZINONES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN LA ROCHE (CH) 2018-04-18 EP disclosed
US-9920049-B2 Dihydroquinolizinones for the treatment and prophylaxis of hepatitis B virus infection HOFFMAN-LA ROCHE INC. (US) 2018-03-20 US disclosed
US-20170057952-A1 NOVEL DIHYDROQUINOLIZINONES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN-LA ROCHE INC. (US) 2017-03-02 US disclosed
US-20160296515-A1 NOVEL DIHYDROQUINOLIZINONES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN-LA ROCHE INC. (US) 2016-10-13 US disclosed
US-9458153-B2 Dihydroquinolizinones for the treatment and prophylaxis of hepatitis B virus infection HOFFMANN-LA ROCHE INC. (US) 2016-10-04 US disclosed
US-20160207914-A9 Novel dihydroquinolizinones for the treatment and prophylaxis of hepatitis B virus infection HOFFMANN-LA ROCHE INC. (US) 2016-07-21 US disclosed
US-20150210682-A1 Novel dihydroquinolizinones for the treatment and prophylaxis of hepatitis B virus infection HOFFMANN-LA ROCHE INC. (US) 2015-07-30 US disclosed
US-8394825-B2 Compound STERIX LIMITED (GB) 2013-03-12 US disclosed
US-20100222299-A1 COMPOUND STERIX LIMITED (GB) 2010-09-02 US disclosed
EP-2155192-A2 TETRAHYDROISOQUINOLINES AS TUMOUR GROWTH INHIBITORS Sterix Limited (GB) 2010-02-24 EP disclosed
WO-2008117061-A2 TETRAHYDROISOQUINOLINES AS TUMOUR GROWTH INHIBITORS STERIX LIMITED (GB) 2008-10-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150210682-A1 Novel dihydroquinolizinones for the treatment and prophylaxis of hepatitis B virus infection HAVCR2, HCCS, DHX15 ALDH1A1 735/4885HPGD 734/4885L3MBTL1 1818/4885
US-20170057952-A1 NOVEL DIHYDROQUINOLIZINONES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HAVCR2, DHX15, DHX35 ALDH1A1 949/4885HPGD 699/4885L3MBTL1 1983/4885
US-12024521-B2 Isoquinoline derivatives, methods of synthesis and uses thereof POLRMT, MAVS, SYNCRIP ALDH1A1 3238/4885HPGD 989/4885L3MBTL1 2381/4885
US-20160207914-A9 Novel dihydroquinolizinones for the treatment and prophylaxis of hepatitis B virus infection HAVCR2, HCCS, DHX15 ALDH1A1 735/4885HPGD 734/4885L3MBTL1 1818/4885
US-20100222299-A1 COMPOUND MKI67, VHL, MYC ALDH1A1 1517/4885HPGD 694/4885L3MBTL1 2523/4885
US-20160296515-A1 NOVEL DIHYDROQUINOLIZINONES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HAVCR2, HCCS, DHX15 ALDH1A1 735/4885HPGD 734/4885L3MBTL1 1818/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.