SCHEMBL8400562

SCHEMBL8400562

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

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL8941046 0.94
SCHEMBL8403793 0.92
SCHEMBL8307021 0.92 PDE4B (0.32) RAB9ASMN1; SMN2
SCHEMBL8303808 0.89 RAB9A (0.31) RAB9ASMN1; SMN2
SCHEMBL8940913 0.86 RAB9A (0.32) RAB9ASMN1; SMN2
SCHEMBL8120654 0.85 RAB9A (0.34) RAB9ASMN1; SMN2
SCHEMBL8403788 0.84
SCHEMBL8121496 0.84 SMN1; SMN2 (0.32) RAB9ASMN1; SMN2
SCHEMBL8941096 0.81 RAB9A (0.33) RAB9ASMN1; SMN2
SCHEMBL8134206 0.81 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5863866-A HERBICIDES TO KILL WEEDS BUT NOT CROPS IDEMITSU KOSAN CO., LTD. (JP) 1999-01-26 US disclosed
EP-0819691-A1 PYRAZOLE DERIVATIVES IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-01-21 EP disclosed