SCHEMBL30869155

SCHEMBL30869155

ClCCNc1cc(-n2cnnc2)cc2c1cnn2C1CCCCO1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.37
▸ RXRB P28702 1/20 0.37
▸ RXRG P48443 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CNR2 P34972 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CYP4F2 P78329 2/20 0.31
▸ CYP4A11 Q02928 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
SCHEMBL30869023 0.85 RXRA (0.35) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL30869033 0.81 RXRA (0.35) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL30869059 0.81 ATR (0.40) RXRARXRBRXRG
SCHEMBL27371606 0.79 ALDH1A1 (0.42) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL27376543 0.79 RXRA (0.41) RXRARXRBRXRGALDH1A1LMNA
SCHEMBL27376514 0.79 ATR (0.42) RXRARXRBRXRG
SCHEMBL30869123 0.79 HTR2C (0.35) RXRARXRBRXRG
SCHEMBL30869147 0.78 METAP2 (0.36) RXRARXRBRXRG
SCHEMBL30797851 0.77 ATR (0.43) RXRARXRBRXRGCNR2
SCHEMBL30869008 0.74 ATR (0.39) RXRARXRBRXRGALDH1A1LMNA

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-4584249-A1 NOVEL COMPOUNDS AS CK2 INHIBITORS Cambridge Enterprise Limited (GB) 2025-07-16 — — EP disclosed
WO-2024052702-A1 NOVEL COMPOUNDS AS CK2 INHIBITORS CAMBRIDGE ENTERPRISE LIMITED (GB) 2024-03-14 — — WO disclosed
Send feedback