SCHEMBL24865129

SCHEMBL24865129

C=C(CC)N(C(=O)CC)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
GLA P06280 1/20 0.44
TSHR P16473 1/20 0.44
TP53 P04637 2/20 0.43
KMT2A Q03164 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 1/20 0.39
OPRM1 P35372 3/20 0.38
SIGMAR1 Q99720 2/20 0.38
LTB4R2 Q9NPC1 1/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 1/20 0.38
OPRD1 P41143 1/20 0.37
JAK2 O60674 1/20 0.37
PAX8 Q06710 1/20 0.37

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
SCHEMBL8619637 0.86 ALDH1A1 (0.52) ALDH1A1GLATSHRTP53KMT2A
Hydrochloric Acid SCHEMBL11688433 0.81 ALDH1A1 (0.47) ALDH1A1GLATSHRTP53KMT2A
SCHEMBL11688425 0.79 ALDH1A1 (0.46) ALDH1A1GLATSHRTP53KMT2A
SCHEMBL6958752 0.78 ALDH1A1 (0.47) ALDH1A1GLATSHRTP53KMT2A
SCHEMBL6961227 0.78 ALDH1A1 (0.44) ALDH1A1GLATSHRTP53KMT2A
SCHEMBL27744093 0.76 SMN1; SMN2 (0.56) ALDH1A1GLATSHRTP53KMT2A
SCHEMBL6965630 0.76 OPRM1 (0.46) ALDH1A1GLATSHRTP53KMT2A
SCHEMBL31211579 0.75 KMT2A (0.42) ALDH1A1GLATSHRTP53KMT2A
SCHEMBL29216483 0.75 ALDH1A1 (0.46) ALDH1A1GLATSHRTP53KMT2A
SCHEMBL11353736 0.75 ALDH1A1 (0.42) ALDH1A1GLATSHRTP53KMT2A

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-2023282236-A1 RARE EARTH COMPLEX 東ソー株式会社 2023-01-12 WO disclosed