SCHEMBL27374342

SCHEMBL27374342

CCC1CCCCC(C)(F)C1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
SIGMAR1 Q99720 3/20 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
SCHEMBL22144017 0.81 APLNR (0.34) CYP1A2
SCHEMBL27375615 0.81 APLNR (0.34) CYP1A2
SCHEMBL16154380 0.79
SCHEMBL19982879 0.77 KDM4E (0.36)
SCHEMBL19508493 0.75 CYP1A2 (0.31) CYP1A2CYP2D6CTDSP1SIGMAR1
SCHEMBL17835279 0.74 APLNR (0.36)
SCHEMBL17490614 0.74 APLNR (0.36)
SCHEMBL17835280 0.74 APLNR (0.36)
SCHEMBL13537222 0.72 CYP1A2 (0.34) CYP1A2SIGMAR1
SCHEMBL2474412 0.71 CYP2D6 (0.33) CYP1A2CYP2D6CTDSP1SIGMAR1

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-2024084363-A1 USE OF PATATIN-LIKE PHOSPHOLIPASE DOMAIN-CONTAINING PROTEIN 3 COMPOUNDS PFIZER INC. (US) 2024-04-25 WO disclosed