SCHEMBL30737502

SCHEMBL30737502

CCCCOC(=O)N1CC(CN(C(=O)C(F)(F)F)C2CC2)C1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CES2 O00748 1/20 0.34
GBA2 Q9HCG7 1/20 0.32
HRH2 P25021 1/20 0.32
HRH1 P35367 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
ALDH1A1 P00352 1/20 0.30
P2RY12 Q9H244 1/20 0.30
LIPC P11150 1/20 0.30
LIPG Q9Y5X9 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
SCHEMBL23924565 0.80 NR1H2 (0.45) ALDH1A1
SCHEMBL23931684 0.76 DPP8 (0.31)
SCHEMBL21101366 0.72 NR1D1 (0.40) ALDH1A1
SCHEMBL4968751 0.72 LMNA (0.53) LMNAPOLBSMN1; SMN2GBA2HRH2
SCHEMBL4968757 0.72 LMNA (0.53) LMNAPOLBSMN1; SMN2GBA2HRH2
SCHEMBL30129902 0.70 LMNA (0.51) LMNAPOLBSMN1; SMN2GBA2HRH2
SCHEMBL30129908 0.70 LMNA (0.51) LMNAPOLBSMN1; SMN2GBA2HRH2
SCHEMBL15133830 0.70 HTR2A (0.42)
SCHEMBL16111541 0.69 LMNA (0.50) LMNAPOLBSMN1; SMN2GBA2HRH2
SCHEMBL29655416 0.69 LMNA (0.50) LMNAPOLBSMN1; SMN2GBA2HRH2

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-2024025389-A1 METHOD FOR PREPARING INTERMEDIATE OF PHTHALAZINONE DERIVATIVE 아이디언스 주식회사 2024-02-01 WO disclosed