SCHEMBL21771103

SCHEMBL21771103

COc1ccc(C(=O)Nc2ccc(N3CCN(c4ccccn4)CC3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.68
NPC1 O15118 2/20 0.68
KMT2A Q03164 5/20 0.67
MAPT P10636 4/20 0.67
ALDH1A1 P00352 4/20 0.67
NR4A1 P22736 1/20 0.67
MCL1 Q07820 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.64
LMNA P02545 2/20 0.63
HSD17B10 Q99714 4/20 0.61
SMN1; SMN2 Q16637 3/20 0.59
MEN1 O00255 2/20 0.59
HPGD P15428 2/20 0.59
NPSR1 Q6W5P4 1/20 0.59
RXFP1 Q9HBX9 1/20 0.59
F10 P00742 4/20 0.58
NAMPT P43490 1/20 0.57
KDM4E B2RXH2 1/20 0.56
ALOX15 P16050 1/20 0.56
PKM P14618 1/20 0.56

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
SCHEMBL31504246 1.00 RAB9A (0.68) RAB9ANPC1KMT2AMAPTALDH1A1
SCHEMBL31254458 0.97 MAPT (0.70) RAB9ANPC1KMT2AMAPTALDH1A1
SCHEMBL30172120 0.93 RAB9A (0.58) RAB9ANPC1KMT2AMAPTALDH1A1
SCHEMBL31254445 0.89 HSD17B10 (0.60) RAB9ANPC1KMT2AMAPTALDH1A1
SCHEMBL22495240 0.89 MAPT (0.55) RAB9ANPC1KMT2AMAPTALDH1A1
SCHEMBL30172113 0.89 MAPT (0.55) RAB9ANPC1KMT2AMAPTALDH1A1
SCHEMBL31504258 0.89 KMT2A (0.62) RAB9AKMT2AMAPTALDH1A1L3MBTL1
SCHEMBL22495233 0.89 KMT2A (0.62) RAB9AKMT2AMAPTALDH1A1L3MBTL1
SCHEMBL31254430 0.89 HSD17B10 (0.62) RAB9ANPC1KMT2AMAPTALDH1A1
SCHEMBL31254420 0.89 HSD17B10 (0.63) RAB9ANPC1KMT2AMAPTALDH1A1

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
EP-3728234-B1 RADIOLABELED COMPOUNDS HOFFMANN LA ROCHE (CH) 2025-05-14 EP claimed
US-11541132-B2 Radiolabeled compounds HOFFMANN-LA ROCHE INC. (US) 2023-01-03 US claimed
EP-3728234-A1 RADIOLABELED COMPOUNDS F. Hoffmann-La Roche AG (CH) 2020-10-28 EP claimed
US-20200316232-A1 RADIOLABELED COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2020-10-08 US claimed
CN-111511732-A Radiolabelled compounds 豪夫迈·罗氏有限公司 2020-08-07 CN claimed
EP-3728234-B1 RADIOLABELED COMPOUNDS HOFFMANN LA ROCHE (CH) 2025-05-14 EP disclosed
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2023-07-25 US disclosed
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2023-07-25 US disclosed
US-11541132-B2 Radiolabeled compounds HOFFMANN-LA ROCHE INC. (US) 2023-01-03 US disclosed
US-11541132-B2 Radiolabeled compounds HOFFMANN-LA ROCHE INC. (US) 2023-01-03 US disclosed
EP-3728234-A1 RADIOLABELED COMPOUNDS F. Hoffmann-La Roche AG (CH) 2020-10-28 EP disclosed
US-20200316232-A1 RADIOLABELED COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2020-10-08 US disclosed
US-20200316232-A1 RADIOLABELED COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2020-10-08 US disclosed
CN-111511732-A Radiolabelled compounds 豪夫迈·罗氏有限公司 2020-08-07 CN disclosed
WO-2020041331-A1 PROTEOLYSIS TARGETING CHIMERIC (PROTAC) COMPOUND WITH E3 UBIQUITIN LIGASE BINDING ACTIVITY AND TARGETING ALPHA-SYNUCLEIN PROTEIN FOR TREATING NEURODEGENERATIVE DISEASES ARVINAS OPERATIONS, INC. (US) 2020-02-27 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 (3 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-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use UCHL1, ADRM1, CRBN RAB9A 2849/4885NPC1 2637/4885KMT2A 2032/4885
US-11541132-B2 Radiolabeled compounds SNCA, APP, BACE1 RAB9A 163/4885NPC1 128/4885KMT2A 4463/4885
US-20200316232-A1 RADIOLABELED COMPOUNDS SNCA, APP, BACE1 RAB9A 160/4885NPC1 137/4885KMT2A 4496/4885

“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.