SCHEMBL8941103

SCHEMBL8941103

CCOC1CCS(=O)(=O)c2c(C)cc(C(=O)c3cnn(CC)c3O)c(C)c21

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.31
LMNA P02545 2/20 0.31
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL8941132 0.92 RAB9A (0.31) LMNARAB9ASMN1; SMN2
SCHEMBL8940947 0.91 SPR (0.30)
SCHEMBL8400385 0.91
SCHEMBL6725623 0.87 RAB9A (0.32) LMNARAB9ASMN1; SMN2
SCHEMBL6732529 0.86 RAB9A (0.31) LMNARAB9ASMN1; SMN2
SCHEMBL8122022 0.84
SCHEMBL8307021 0.84 PDE4B (0.32) PDE4BLMNARAB9ASMN1; SMN2
SCHEMBL8303171 0.83
SCHEMBL8130838 0.83 TNF (0.32) LMNARAB9ASMN1; SMN2
SCHEMBL8941036 0.83 RAB9A (0.33) RAB9ASMN1; SMN2

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
US-5587484-A HALOGENATION; OXIDATION; SULFONATION; HERBICIDES IDEMITSU KOSAN CO., LTD. (JP) 1996-12-24 US disclosed