SCHEMBL29338902

SCHEMBL29338902

CCC/C=C/CCN(C)CCC

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.31
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
CA3 P07451 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
CA5A P35218 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30
CA14 Q9ULX7 1/20 0.30
CA5B Q9Y2D0 1/20 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
SCHEMBL29339536 1.00 SIGMAR1 (0.31) SIGMAR1CA12CA2CA3CA4
SCHEMBL14618009 0.87 FFAR1 (0.31) SIGMAR1
SCHEMBL27413945 0.87 FFAR1 (0.31) SIGMAR1
SCHEMBL15835829 0.82 KDM5A (0.32) SIGMAR1
SCHEMBL18900691 0.81 FAAH (0.50)
SCHEMBL19288792 0.80
SCHEMBL317978 0.78 TRPA1 (0.33)
SCHEMBL13868129 0.78 DNM1 (0.39) CA12CA2CA3CA4CA6
SCHEMBL23108051 0.77
SCHEMBL15835858 0.77

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
EP-4400107-A1 IONIZABLE LIPOSOME, PREPARATION THEREOF, AND APPLICATION THEREOF IN GENE DELIVERY Maxirna (Zhejiang) Technology Co., Ltd. (CN) 2024-07-17 EP disclosed