SCHEMBL29268908

SCHEMBL29268908

O=C(O)c1ncc(-c2ccccc2C2CC2)o1.[LiH]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.42
FAAH O00519 13/20 0.42
ASPH Q12797 1/20 0.37
KDM8 Q8N371 1/20 0.37
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36
TUBB2A Q13885 1/20 0.36
TUBB8 Q3ZCM7 1/20 0.36
TUBA3E Q6PEY2 1/20 0.36
TUBA1A Q71U36 1/20 0.36
TUBA1C Q9BQE3 1/20 0.36
TUBB6 Q9BUF5 1/20 0.36
TUBB2B Q9BVA1 1/20 0.36
TUBB1 Q9H4B7 1/20 0.36
NPC1 O15118 1/20 0.36

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
Lithium SCHEMBL30975782 0.97 DHODH (0.42) DHODHFAAHASPHKDM8TUBB4A
Lithium Ion SCHEMBL25209903 0.84 FAAH (0.37) DHODHFAAH
SCHEMBL25675614 0.82 FAAH (0.46) DHODHFAAHNPC1GAARAB9A
SCHEMBL29269008 0.80 FAAH (0.40) FAAH
SCHEMBL30474070 0.79 ALDH1A1 (0.43) FAAH
SCHEMBL25242500 0.79 ALDH1A1 (0.43) FAAH
Lithium SCHEMBL30975802 0.77 FAAH (0.40) FAAH
SCHEMBL6834403 0.76 FAAH (0.61) FAAHNPC1GAARAB9A
SCHEMBL4790263 0.75 TUBB4A (0.57) FAAHTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL892926 0.73 TUBB4A (0.59) FAAHTUBB4ATUBBTUBA3CTUBA1B

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
CN-118302422-A Substituted N-cyanopyrrolidines having activity as USP30 inhibitors 特殊治疗有限公司 2024-07-05 CN disclosed