SCHEMBL30236348

SCHEMBL30236348

CCOC(OCC)C(=N)NCc1cc(Br)cc(Br)c1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.31
PPARG P37231 1/20 0.30
PPARD Q03181 1/20 0.30
PPARA Q07869 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL23301085 0.90 TACR1 (0.38)
SCHEMBL558857 0.85 LMNA (0.46) LMNAHPGD
SCHEMBL558231 0.84 MEN1 (0.42) LMNA
SCHEMBL29272470 0.81 ERCC1 (0.36) PPARGPPARDPPARALMNAHPGD
SCHEMBL21634929 0.78 CARM1 (0.35) PPARGPPARDPPARA
SCHEMBL30907399 0.77 TSHR (0.33) LMNA
SCHEMBL24271320 0.77 TSHR (0.44) LMNAHPGD
SCHEMBL1824023 0.77 PPID (0.45) IDO1PPARGPPARAHPGD
SCHEMBL2552204 0.75 PYCR1 (0.34) LMNA
SCHEMBL2549136 0.75 LMNA (0.36) LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4399210-A1 6-AZA-QUINOLINE DERIVATIVES AND RELATED USES Black Diamond Therapeutics, Inc. (US) 2024-07-17 EP disclosed
WO-2023039505-A1 6-AZA-QUINOLINE DERIVATIVES AND RELATED USES BLACK DIAMOND THERAPEUTICS, INC. (US) 2023-03-16 WO disclosed