SCHEMBL20745346

SCHEMBL20745346

COCCOCCOCCOCc1ccc(Br)c(OCCOCCOCCOC)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 12/20 0.54
L3MBTL1 Q9Y468 6/20 0.43
MAPT P10636 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HTR1A P08908 10/20 0.41
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.38
CYP2D6 P10635 3/20 0.38
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL20745053 0.86 SLC6A4 (0.53) SLC6A4L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL925035 0.86 SLC6A4 (0.46) SLC6A4L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL22262492 0.83 SLC6A4 (0.46) SLC6A4L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL3713282 0.83 SLC6A4 (0.43) SLC6A4L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL3713287 0.83 SLC6A4 (0.43) SLC6A4L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL20745095 0.83 SLC6A4 (0.43) SLC6A4L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL3713288 0.83 SLC6A4 (0.43) SLC6A4L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL1346422 0.82 SLC6A4 (0.58) SLC6A4L3MBTL1MAPTALDH1A1HTR1A
SCHEMBL3713284 0.82 SLC6A4 (0.42) SLC6A4L3MBTL1MAPTSMN1; SMN2ALDH1A1
SCHEMBL30808273 0.81 SLC6A4 (0.57) SLC6A4L3MBTL1SMN1; SMN2ALDH1A1HTR1A

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-20250313572-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE ABBVIE INC (US) 2025-10-09 US disclosed
US-20240228509-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE ABBVIE INC (US) 2024-07-11 US disclosed
US-20230399340-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE ABBVIE INC (US) 2023-12-14 US disclosed
US-20200239494-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE ABBVIE INC (US) 2020-07-30 US disclosed
EP-3668502-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE AbbVie Inc. (US) 2020-06-24 EP disclosed
WO-2019035927-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE ABBVIE INC. (US) 2019-02-21 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 (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-20240228509-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE MCL1, BCL2A1, BCL2L10 SLC6A4 4507/4885L3MBTL1 76/4885MAPT 4497/4885
US-20200239494-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE MCL1, BCL2A1, BCL2L10 SLC6A4 4507/4885L3MBTL1 76/4885MAPT 4497/4885
US-20250313572-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE MCL1, BCL2A1, BCL2L10 SLC6A4 4507/4885L3MBTL1 76/4885MAPT 4497/4885
US-20230399340-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE MCL1, BCL2A1, BCL2L10 SLC6A4 4507/4885L3MBTL1 76/4885MAPT 4497/4885

“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.