SCHEMBL15568747

SCHEMBL15568747

O=C(O)C(c1cccc(Br)c1)C1CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 2/20 0.42
MBTD1 Q05BQ5 1/20 0.40
L3MBTL3 Q96JM7 1/20 0.40
ALDH1A1 P00352 2/20 0.40
TP53 P04637 1/20 0.40
SLC18A3 Q16572 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
IDO1 P14902 1/20 0.39
TDO2 P48775 1/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HTR1E P28566 1/20 0.39
KMT2A Q03164 1/20 0.39
S1PR3 Q99500 1/20 0.39
HDAC4 P56524 1/20 0.39

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
SCHEMBL30872136 1.00 SLC6A9 (0.42) SLC6A9MBTD1L3MBTL3ALDH1A1TP53
SCHEMBL24662205 0.94 HTR1E (0.43) SLC6A9MBTD1L3MBTL3MEN1LMNA
SCHEMBL4242551 0.94 HTR1E (0.47) SLC6A9MBTD1L3MBTL3MEN1LMNA
SCHEMBL30911380 0.92 MEN1 (0.46) MBTD1L3MBTL3ALDH1A1MEN1LMNA
SCHEMBL27336300 0.92 MEN1 (0.46) MBTD1L3MBTL3ALDH1A1MEN1LMNA
SCHEMBL30374644 0.81 HTR1E (0.41) SLC6A9MBTD1L3MBTL3ALDH1A1MEN1
SCHEMBL24662249 0.81 SLC6A3 (0.53)
SCHEMBL30375011 0.81 SLC6A3 (0.53)
SCHEMBL24662243 0.81 HTR1E (0.41) SLC6A9MBTD1L3MBTL3ALDH1A1MEN1
SCHEMBL30903019 0.81 MEN1 (0.40) SLC6A9MBTD1L3MBTL3MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118139856-A Parallel-ring compounds as Cbl-b inhibitors 海南先声再明医药股份有限公司 2024-06-04 CN disclosed
CN-117940404-A Tricyclic compounds as Cbl-b inhibitors 海南先声再明医药股份有限公司 2024-04-26 CN disclosed
WO-2023072273-A1 POLYCYCLIC COMPOUND AS CBL-B INHIBITOR 先声再明医药有限公司 2023-05-04 WO disclosed
WO-2023072273-A1 POLYCYCLIC COMPOUND AS CBL-B INHIBITOR 先声再明医药有限公司 2023-05-04 WO disclosed
WO-2023036330-A1 TRICYCLIC COMPOUND AS CBL-B INHIBITOR 先声再明医药有限公司 2023-03-16 WO disclosed
WO-2022221704-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING CANCER HOTSPOT THERAPEUTICS, INC. (US) 2022-10-20 WO disclosed
EP-2885291-A1 VEGFR3 INHIBITORS Cancer Therapeutics Crc Pty Limited (AU) 2015-06-24 EP disclosed
WO-2014026243-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2014-02-20 WO disclosed