SCHEMBL29909192

SCHEMBL29909192

Fc1cccc2nc(Cl)nc(N3CCOCc4c(Br)cccc43)c12

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.35
BCR P11274 2/20 0.35
AKT1 P31749 4/20 0.34
ACHE P22303 3/20 0.34
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP2A13 Q16696 1/20 0.32
PTGS2 P35354 3/20 0.32
TSHR P16473 1/20 0.31
PIK3CA P42336 2/20 0.31

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
SCHEMBL23577305 1.00 ABL1 (0.35) ABL1BCRAKT1ACHEALDH1A1
SCHEMBL29162213 0.91 AKT1 (0.32) ABL1BCRAKT1
SCHEMBL24813185 0.90 AKT1 (0.35) ABL1BCRAKT1PTGS2TSHR
SCHEMBL24807050 0.89 ABL1 (0.33) ABL1BCRAKT1PTGS2TSHR
SCHEMBL24815924 0.87 PIK3R2 (0.33) ABL1BCRACHEPTGS2PIK3CA
SCHEMBL24813179 0.86 ACHE (0.41) ABL1BCRACHE
SCHEMBL29909599 0.85 ACHE (0.43) ABL1BCRACHE
SCHEMBL23576812 0.85 ACHE (0.43) ABL1BCRACHE
SCHEMBL23576881 0.85 ACHE (0.34) ABL1BCRAKT1ACHEALDH1A1
SCHEMBL29909109 0.85 ACHE (0.34) ABL1BCRAKT1ACHEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 CN disclosed
EP-4359389-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2024-05-01 EP disclosed
EP-4359415-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2024-05-01 EP disclosed
WO-2022271677-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2022-12-29 WO disclosed
WO-2022271684-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2022-12-29 WO disclosed
CN-115362003-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2022-11-18 CN disclosed
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP disclosed