SCHEMBL28182181

SCHEMBL28182181

CCC[N+](C)(CCC)CCCO

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HSD17B10 Q99714 1/20 0.41
TSHR P16473 1/20 0.41
DNM1 Q05193 3/20 0.41
PSMD14 O00487 1/20 0.35
PLA2G1B P04054 1/20 0.35
MMP2 P08253 1/20 0.35
RAD52 P43351 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
CYP3A4 P08684 1/20 0.35
SLC5A7 Q9GZV3 1/20 0.35

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
SCHEMBL12396079 0.89 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL2143447 0.88 LMNA (0.42) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
Water SCHEMBL2780523 0.85 LMNA (0.40) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL4454715 0.84 DNM1 (0.60) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL10622055 0.84 DNM1 (0.60) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL20749391 0.82 LMNA (0.45) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL15034040 0.82 LMNA (0.45) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL28454705 0.82 DNM1 (0.58) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL28450551 0.82 DNM1 (0.58) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL5604447 0.82 DNM1 (0.58) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A

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-107406534-A Ionomer resin, ionomer solution containing the ionomer resin, laminate, member, electrochemical element, and electrochemical device 日东电工株式会社 2017-11-28 CN disclosed
CN-107405617-A Anion exchange membrane, electrochemical element and electrochemical device having the same 日东电工株式会社 2017-11-28 CN disclosed