SCHEMBL8940913

SCHEMBL8940913

CCn1ncc(C(=O)c2ccc3c(c2C)C(OC(C)C)CCS3(=O)=O)c1O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL8303808 0.90 RAB9A (0.31) RAB9ASMN1; SMN2
SCHEMBL8307021 0.89 PDE4B (0.32) RAB9ASMN1; SMN2
SCHEMBL8941046 0.87
SCHEMBL8400562 0.86 RAB9A (0.31) RAB9ASMN1; SMN2
SCHEMBL8403793 0.86
SCHEMBL8121496 0.85 SMN1; SMN2 (0.32) RAB9ASMN1; SMN2
SCHEMBL8120654 0.84 RAB9A (0.34) RAB9ASMN1; SMN2
SCHEMBL8134206 0.82 RAB9A (0.33) RAB9ASMN1; SMN2
SCHEMBL8132414 0.82 SMN1; SMN2 (0.33) RAB9ASMN1; SMN2
SCHEMBL8941166 0.81

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