SCHEMBL21765844

SCHEMBL21765844

O=C(CBr)Nc1cccc(NC(=O)CBr)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.56
NR4A1 P22736 1/20 0.56
RAB9A P51151 1/20 0.56
KMT2A Q03164 7/20 0.55
MEN1 O00255 4/20 0.55
GAA P10253 2/20 0.55
MAPT P10636 1/20 0.55
JAK3 P52333 1/20 0.54
GPR35 Q9HC97 1/20 0.52
LMNA P02545 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
F2R P25116 1/20 0.49
KCNK3 O14649 1/20 0.48
KCNK9 Q9NPC2 1/20 0.48
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 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
SCHEMBL11639511 0.91 RAB9A (0.72) POLBNR4A1RAB9AKMT2AMEN1
SCHEMBL11403762 0.88 NLRP3 (0.62) RAB9AKMT2AMEN1MAPTHDAC4
SCHEMBL3715355 0.88 GAA (0.72) RAB9AKMT2AMEN1GAAMAPT
SCHEMBL15094368 0.87 TRPV1 (0.50) POLBNR4A1RAB9AKMT2AMEN1
SCHEMBL333559 0.87 MEN1 (0.65) RAB9AKMT2AMEN1MAPTLMNA
SCHEMBL30203791 0.87 MEN1 (0.77) POLBRAB9AKMT2AMEN1MAPT
SCHEMBL1355791 0.87 JAK3 (0.48) POLBNR4A1RAB9AKMT2AMEN1
SCHEMBL375021 0.87 MEN1 (0.77) POLBRAB9AKMT2AMEN1MAPT
SCHEMBL2189147 0.87 HPGD (0.66) POLBRAB9AKMT2AMEN1HDAC3
SCHEMBL29748804 0.87 MEN1 (0.65) RAB9AKMT2AMEN1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220249687-A1 BIS(2-HALOACETAMIDO)-COMPOUNDS FOR USE AS LINKING AGENTS AND RESULTANT PRODUCTS WHICH COMPRISE ANTIBODIES, HALF-ANTIBODIES AND ANTIBODY FRAGMENTS THE UNIVERSITY OF BATH (GB) 2022-08-11 US disclosed
EP-3990023-A1 BIS(2-HALOACETAMIDO)-COMPOUNDS FOR USE AS LINKING AGENTS AND RESULTANT PRODUCTS WHICH COMPRISE ANTIBODIES, HALF-ANTIBODIES AND ANTIBODY FRAGMENTS The University Of Bath (GB) 2022-05-04 EP disclosed
US-20210179665-A1 COLLECTIONS OF PEPTIDES, PEPTIDE AGENTS, AND METHODS OF USE THEREOF PARABILIS MEDICINES, INC. 2021-06-17 US disclosed
WO-2020260514-A1 BIS(2-HALOACETAMIDO)-COMPOUNDS FOR USE AS LINKING AGENTS AND RESULTANT PRODUCTS WHICH COMPRISE ANTIBODIES, HALF-ANTIBODIES AND ANTIBODY FRAGMENTS THE UNIVERSITY OF BATH (GB) 2020-12-30 WO disclosed
WO-2020041270-A1 COLLECTIONS OF PEPTIDES, PEPTIDE AGENTS, AND METHODS OF USE THEREOF FOG PHARMACEUTICALS, 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 (2 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-20220249687-A1 BIS(2-HALOACETAMIDO)-COMPOUNDS FOR USE AS LINKING AGENTS AND RESULTANT PRODUCTS WHICH COMPRISE ANTIBODIES, HALF-ANTIBODIES AND ANTIBODY FRAGMENTS PAICS, PA2G4, GSTM2 POLB 1899/4885NR4A1 4866/4885RAB9A 2174/4885
US-20210179665-A1 COLLECTIONS OF PEPTIDES, PEPTIDE AGENTS, AND METHODS OF USE THEREOF IAPP, VIP, NGLY1 POLB 1083/4885NR4A1 4860/4885RAB9A 2325/4885

“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.