SCHEMBL31472002

SCHEMBL31472002

NCCCC(O)(CCCN)CCCO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 4/20 0.41
PDE3A Q14432 1/20 0.41
TSHR P16473 2/20 0.37
ALDH1A1 P00352 1/20 0.37
ODC1 P11926 2/20 0.32
NFKB1 P19838 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.30
LMNA P02545 2/20 0.30
BLM P54132 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
PMP22 Q01453 1/20 0.30
CA12 O43570 2/20 0.30
CA1 P00915 2/20 0.30
CA2 P00918 2/20 0.30
CA3 P07451 2/20 0.30
CA4 P22748 2/20 0.30
CA6 P23280 2/20 0.30
CA5A P35218 2/20 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
SCHEMBL9312417 0.95 FDPS (0.38) FDPSPDE3ATSHRALDH1A1ODC1
SCHEMBL17669189 0.85 SMN1; SMN2 (0.39) TSHRALDH1A1SMN1; SMN2LMNA
SCHEMBL1837665 0.80 FDPS (0.42) FDPSPDE3ATSHRALDH1A1ODC1
SCHEMBL6472790 0.80 TSHR (0.39) FDPSPDE3ATSHRALDH1A1ODC1
SCHEMBL125005 0.79 SMN1; SMN2 (0.35) TSHRALDH1A1SMN1; SMN2LMNA
Methyl Alcohol SCHEMBL3866911 0.79 SMN1; SMN2 (0.42) TSHRALDH1A1SMN1; SMN2LMNA
SCHEMBL7701933 0.77 SMN1; SMN2 (0.33) TSHRALDH1A1SMN1; SMN2LMNA
SCHEMBL9556628 0.77 FDPS (0.50) FDPSPDE3ATSHRODC1NFKB1
SCHEMBL3116 0.75
SCHEMBL28083590 0.75 NFKB1 (0.58) TSHRALDH1A1NFKB1SMN1; SMN2LMNA

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
CN-119768448-A Coating composition PPG工业俄亥俄公司 2025-04-04 CN disclosed
CN-119731231-A Coating composition PPG工业俄亥俄公司 2025-03-28 CN disclosed