SCHEMBL8617475

SCHEMBL8617475

CCn1ncc(C(=O)c2ccc3c(c2C)C(OC)CCS3(=O)=O)c1OCc1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 14/20 0.34
PDE4B Q07343 3/20 0.31
PIK3CD O00329 1/20 0.31
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL9039136 0.87
SCHEMBL8618473 0.85
SCHEMBL8940922 0.85 NPC1 (0.30) SMN1; SMN2
SCHEMBL8303808 0.83 RAB9A (0.31) PDE4BSMN1; SMN2
SCHEMBL8461921 0.83 LMNA (0.33) PDE4B
SCHEMBL8613647 0.78 F2 (0.32) MAPT
SCHEMBL8940979 0.77 NPC1 (0.30) SMN1; SMN2
SCHEMBL8128911 0.75
SCHEMBL8304037 0.75
SCHEMBL8941096 0.75 RAB9A (0.33) PDE4BSMN1; 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-5849926-A Pyrazole derivatives and herbicides containing the same IDEMITSU KOSAN CO., LTD. (JP) 1998-12-15 US disclosed
EP-0728756-A1 PYRAZOLE DERIVATIVES AND HERBICIDE CONTAINING THE SAME IDEMITSU KOSAN COMPANY LIMITED (JP) 1996-08-28 EP disclosed