SCHEMBL29358232

SCHEMBL29358232

N#CCc1ccc2c(c1)OCO2

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.55
CYP3A4 P08684 5/20 0.53
SLC6A4 P31645 3/20 0.53
CYP1A2 P05177 2/20 0.53
MAPT P10636 1/20 0.53
MIF P14174 1/20 0.53
SLC6A2 P23975 2/20 0.50
SLC6A3 Q01959 2/20 0.50
CYP2D6 P10635 2/20 0.50
CMA1 P23946 1/20 0.50
HTT P42858 1/20 0.49
ALDH1A1 P00352 2/20 0.49
GAA P10253 1/20 0.49
CYP2C19 P33261 1/20 0.49
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CALM1 P0DP23 1/20 0.47

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
SCHEMBL141712 1.00 TAAR1 (0.55) TAAR1CYP3A4SLC6A4CYP1A2MAPT
SCHEMBL2963428 0.93 TAAR1 (0.49) TAAR1CYP3A4SLC6A4CYP1A2MAPT
SCHEMBL8992885 0.90 HTT (0.51) TAAR1CYP3A4SLC6A4CYP1A2MAPT
SCHEMBL1464785 0.89 CD274 (0.50) TAAR1CYP3A4SLC6A4CYP1A2MAPT
SCHEMBL7947382 0.82 MMP3 (0.56) MAPTALDH1A1PKMTSHRKMT2A
SCHEMBL8249225 0.81 TAAR1 (0.61) TAAR1CYP3A4SLC6A4CYP1A2MAPT
SCHEMBL2119072 0.81 TAAR1 (0.59) TAAR1CYP3A4SLC6A4CYP1A2MAPT
SCHEMBL5966222 0.81 TAAR1 (0.55) TAAR1CYP3A4SLC6A4CYP1A2MAPT
SCHEMBL11082938 0.78 TAAR1 (0.60) TAAR1CYP3A4SLC6A4CYP1A2MAPT
SCHEMBL1721517 0.78 SLC5A2 (0.38) TAAR1CYP3A4SLC6A4CYP1A2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479801-B2 Process for the manufacturing of (6aR,10aR)-7-propyl-6,6a,7,8,9,10,10a,11-octahydro-[1,3]dioxolo[4′,5′:5,6]benzo[1,2-g]quinoline and (4aR,10aR)-1-propyl-1,2,3,4,4a,5,10,10a-octahydro-benzo[g]quinoline-6,7-diol H. LUNDBECK A/S (DK) 2025-11-25 US disclosed
CN-118908964-A Method for producing a compound H.隆德贝克有限公司 2024-11-08 CN disclosed
CN-113874355-B Process for the manufacture of (6 AR,10 AR) -7-propyl-6, 6A,7,8,9, 10A, 11-octahydro- [1,3] dioxolo [4',5':5,6] benzo [1,2-G ] quinoline and (4 AR,10 AR) -1-propyl-1, 2,3, 4A,5, 10A-octahydro-benzo [ G ] quinoline-6, 7-diol H.隆德贝克有限公司 2024-07-30 CN disclosed
US-20240018107-A1 PROCESS FOR THE MANUFACTURING OF (6AR,10AR)-7-PROPYL-6,6A,7,8,9,10,10A,11-OCTAHYDRO-[1,3]DIOXOLO[4',5':5,6]BENZO[1,2-G]QUINOLINE AND (4AR,10AR)-1-PROPYL-1,2,3,4,4A,5,10,10A-OCTAHYDRO-BENZO[G]QUINOLINE-6,7-DIOL H. LUNDBECK A/S (DK) 2024-01-18 US disclosed
US-11866410-B2 Process for the manufacturing of (6AR,10AR)-7-propyl-6,6A,7,8,9,10,10A,11-octahydro-[1,3]dioxolo[4′,5′:5,6]benzo[1,2-G]quinoline and (4AR, 10AR)-1-propyl-1,2,3,4,4A,5,10,10A-octahydro-benzo[G]quinoline-6,7-diol H. LUNDBECK A/S (DK) 2024-01-09 US disclosed
US-20220024875-A1 PROCESS FOR THE MANUFACTURING OF (6AR,10AR)-7-PROPYL-6,6A,7,8,9,10,10A,11-OCTAHYDRO-[1,3]DIOXOLO[4',5':5,6]BENZO[1,2-G]QUINOLINE AND (4AR,10AR)-1-PROPYL-1,2,3,4,4A,5,10,10A-OCTAHYDRO-BENZO[G]QUINOLINE-6,7-DIOL H. LUNDBECK A/S (DK) 2022-01-27 US 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 (4 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-20220024875-A1 PROCESS FOR THE MANUFACTURING OF (6AR,10AR)-7-PROPYL-6,6A,7,8,9,10,10A,11-OCTAHYDRO-[1,3]DIOXOLO[4',5':5,6]BENZO[1,2-G]QUINOLINE AND (4AR,10AR)-1-PROPYL-1,2,3,4,4A,5,10,10A-OCTAHYDRO-BENZO[G]QUINOLINE-6,7-DIOL PARK7, SNCA, CYP1B1 TAAR1 420/4885CYP3A4 118/4885SLC6A4 1446/4885
US-11866410-B2 Process for the manufacturing of (6AR,10AR)-7-propyl-6,6A,7,8,9,10,10A,11-octahydro-[1,3]dioxolo[4′,5′:5,6]benzo[1,2-G]quinoline and (4AR, 10AR)-1-propyl-1,2,3,4,4A,5,10,10A-octahydro-benzo[G]quinoline-6,7-diol PARK7, SNCA, CYP1B1 TAAR1 416/4885CYP3A4 115/4885SLC6A4 1435/4885
US-20240018107-A1 PROCESS FOR THE MANUFACTURING OF (6AR,10AR)-7-PROPYL-6,6A,7,8,9,10,10A,11-OCTAHYDRO-[1,3]DIOXOLO[4',5':5,6]BENZO[1,2-G]QUINOLINE AND (4AR,10AR)-1-PROPYL-1,2,3,4,4A,5,10,10A-OCTAHYDRO-BENZO[G]QUINOLINE-6,7-DIOL PARK7, SNCA, CYP1B1 TAAR1 434/4885CYP3A4 137/4885SLC6A4 1416/4885
US-12479801-B2 Process for the manufacturing of (6aR,10aR)-7-propyl-6,6a,7,8,9,10,10a,11-octahydro-[1,3]dioxolo[4′,5′:5,6]benzo[1,2-g]quinoline and (4aR,10aR)-1-propyl-1,2,3,4,4a,5,10,10a-octahydro-benzo[g]quinoline-6,7-diol PARK7, SNCA, CYP1B1 TAAR1 430/4885CYP3A4 130/4885SLC6A4 1399/4885

“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.