SCHEMBL31334420

SCHEMBL31334420

OC1(CN2CCNCC2)CCNCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 1/20 0.39
HSD17B10 Q99714 1/20 0.34
SLC6A2 P23975 10/20 0.33
SLC6A4 P31645 6/20 0.33
CXCR4 P61073 2/20 0.33
CHRM5 P08912 1/20 0.32
CHRM3 P20309 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
SLC6A3 Q01959 4/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 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
SCHEMBL3295637 0.89 CYP2D6 (0.33) SMN1; SMN2SLC6A2SLC6A4CXCR4SLC6A3
SCHEMBL1990941 0.89 CYP2D6 (0.33) SMN1; SMN2POLBSLC6A2SLC6A4CXCR4
Hydrochloric Acid SCHEMBL3301867 0.87 CYP2D6 (0.33) SLC6A2SLC6A4CXCR4SLC6A3ALDH1A1
SCHEMBL2954235 0.84 SMN1; SMN2 (0.42) SMN1; SMN2POLBHSD17B10SLC6A2SLC6A4
SCHEMBL16565596 0.84 CXCR4 (0.33) SLC6A2SLC6A4CXCR4SLC6A3MEN1
SCHEMBL1934727 0.84 SMN1; SMN2 (0.43) SMN1; SMN2POLBSLC6A2SLC6A4MEN1
SCHEMBL22295536 0.84 ADRA2C (0.31)
SCHEMBL23267546 0.84 SMN1; SMN2 (0.40) SMN1; SMN2POLBHSD17B10SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL964646 0.82 ALDH1A1 (0.45) SMN1; SMN2POLBHSD17B10SLC6A2SLC6A4
SCHEMBL25971174 0.82 SMN1; SMN2 (0.39) SMN1; SMN2POLBHSD17B10SLC6A2SLC6A4

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-4709720-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN Larkspur Biosciences, Inc. (US) 2026-03-18 EP disclosed
WO-2024233846-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES, INC. (US) 2024-11-14 WO disclosed