SCHEMBL31585725

SCHEMBL31585725

Nc1c(Cl)ccc2c1cnn2C1CCCCO1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ RXRA P19793 1/20 0.43
▸ RXRB P28702 1/20 0.43
▸ RXRG P48443 1/20 0.43
▸ CYP4F2 P78329 5/20 0.37
▸ CYP4A11 Q02928 5/20 0.37
▸ RET P07949 2/20 0.36
▸ MAP4K1 Q92918 1/20 0.34
▸ DGAT2 Q96PD7 1/20 0.34
▸ GAA P10253 1/20 0.33
▸ YTHDC1 Q96MU7 1/20 0.33
▸ HPGD P15428 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ TP53 P04637 1/20 0.32

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
SCHEMBL21195976 0.85 RXRA (0.46) LMNAALDH1A1POLBRXRARXRB
SCHEMBL21198430 0.85 ALDH1A1 (0.45) LMNAALDH1A1POLBRXRARXRB
SCHEMBL20132934 0.85 ALDH1A1 (0.45) LMNAALDH1A1POLBRXRARXRB
SCHEMBL19949097 0.85 RXRA (0.43) LMNAALDH1A1POLBRXRARXRB
SCHEMBL17681723 0.85 RXRA (0.43) LMNAALDH1A1POLBRXRARXRB
SCHEMBL31105959 0.85 ALDH1A1 (0.45) LMNAALDH1A1POLBRXRARXRB
SCHEMBL21263636 0.85 RXRA (0.43) LMNAALDH1A1POLBRXRARXRB
SCHEMBL24373169 0.82 RXRA (0.42) LMNAALDH1A1POLBRXRARXRB
SCHEMBL29478967 0.82 RXRA (0.42) LMNAALDH1A1POLBRXRARXRB
SCHEMBL5409241 0.82 ALDH1A1 (0.45) LMNAALDH1A1POLBRXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025106014-A1 COMPOUNDS AND METHODS FOR PKMYT1 INHIBITION ENGINE BIOSCIENCES PTE. LTD. (SG) 2025-05-22 — — WO disclosed
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