SCHEMBL31038604

SCHEMBL31038604

CCCCC(=N)N.O=S(=O)(O)CCO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 1/20 0.50
SPHK1 Q9NYA1 1/20 0.50
LMNA P02545 4/20 0.41
ALDH1A1 P00352 4/20 0.41
POLB P06746 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KDM4E B2RXH2 3/20 0.41
BLM P54132 3/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 2/20 0.41
NPC1 O15118 1/20 0.41
ALOX15 P16050 1/20 0.41
BRCA1 P38398 1/20 0.41
HTT P42858 1/20 0.41
GMNN O75496 1/20 0.41
PKM P14618 1/20 0.41
THPO P40225 1/20 0.41
MTOR P42345 1/20 0.41
RECQL P46063 1/20 0.41
HIF1A Q16665 1/20 0.41

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
SCHEMBL20298428 0.95 SPHK2 (0.59) SPHK2SPHK1LMNAALDH1A1POLB
SCHEMBL27585249 0.95 SPHK2 (0.59) SPHK2SPHK1LMNAALDH1A1POLB
SCHEMBL28032982 0.93 SPHK2 (0.62) SPHK2SPHK1LMNAALDH1A1POLB
SCHEMBL21802163 0.93 SPHK2 (0.62) SPHK2SPHK1LMNAALDH1A1POLB
Sulfuric Acid SCHEMBL9701273 0.84 SPHK1 (0.62) SPHK2SPHK1ALDH1A1KDM4EBLM
SCHEMBL31289294 0.82 LMNA (0.42) LMNAALDH1A1POLBSMN1; SMN2KDM4E
Pentane SCHEMBL8915985 0.80 APP (0.46) LMNAALDH1A1POLBSMN1; SMN2BLM
Hexane SCHEMBL27317543 0.80 SMN1; SMN2 (0.48) LMNAALDH1A1SMN1; SMN2APPTP53
SCHEMBL27689668 0.79 SOAT1 (0.48) ALDH1A1KDM4EALOX15TP53CYP2C19
Pentane SCHEMBL8905837 0.78 APP (0.44) LMNAALDH1A1POLBSMN1; SMN2BLM

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-118480173-B Cationic polyester and preparation method and application thereof 深圳市信必递生物科技有限公司 2025-02-07 CN disclosed
CN-118480173-A Cationic polyester and preparation method and application thereof 深圳市信必递生物科技有限公司 2024-08-13 CN disclosed