SCHEMBL29810232

SCHEMBL29810232

O=C(O)c1ccc(Br)c(Br)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.56
TSHR P16473 2/20 0.52
TP53 P04637 1/20 0.52
CA12 O43570 4/20 0.50
CA1 P00915 4/20 0.50
CA2 P00918 4/20 0.50
CA6 P23280 4/20 0.50
CA9 Q16790 4/20 0.50
CA4 P22748 3/20 0.50
CA7 P43166 3/20 0.50
CA14 Q9ULX7 3/20 0.50
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
PTGS2 P35354 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HPGD P15428 2/20 0.49
HTT P42858 1/20 0.49
TDP1 Q9NUW8 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
SCHEMBL588825 1.00 TTR (0.56) TTRTSHRTP53CA12CA1
SCHEMBL11507721 0.83 TTR (0.54) TTRTSHRTP53CA12CA1
SCHEMBL30162908 0.81 TTR (0.52) TTRTSHRTP53CA12CA1
SCHEMBL312791 0.81 CA12 (0.64) TTRTSHRTP53CA12CA1
SCHEMBL30436340 0.81 CA12 (0.64) TTRTSHRTP53CA12CA1
SCHEMBL29875457 0.81 CPT1B (0.48) TTRTSHRTP53MAPTHPGD
SCHEMBL71015 0.81 TTR (0.52) TTRTSHRTP53CA12CA1
SCHEMBL11820504 0.81 TTR (0.52) TTRTSHRTP53CA12CA1
SCHEMBL1812684 0.81 CA12 (0.64) TTRTSHRTP53CA12CA1
SCHEMBL70653 0.81 KDM4E (0.52) TTRTSHRTP53CA12CA1

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
CN-119253090-A Zn-I2Battery electrolyte and preparation method and application thereof 中国科学院大连化学物理研究所 2025-01-03 CN claimed
WO-2025072511-A1 TAILORING NON-EQUILIBRIUM PATHWAYS FOR THE SELECTIVE FORMATION OF INTERMEDIATE COMPOUNDS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-04-03 WO disclosed
CN-119253090-A Zn-I2Battery electrolyte and preparation method and application thereof 中国科学院大连化学物理研究所 2025-01-03 CN disclosed
CN-118239961-A Preparation and use of cap-dependent endonuclease inhibitors 深圳安泰维生物医药有限公司 2024-06-25 CN disclosed
CN-115073445-B Organic luminescent material based on selenohexanthrone and preparation method and application thereof 中国科学院长春应用化学研究所 2024-02-13 CN disclosed
CN-115073445-A Organic luminescent material based on selenium heteroanthrone and preparation method and application thereof 中国科学院长春应用化学研究所 2022-09-20 CN disclosed