SCHEMBL9835882

SCHEMBL9835882

CCC(=O)OC1CCCCC=C1O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.37
CHRM4 P08173 2/20 0.37
CHRM1 P11229 2/20 0.37
CHRM3 P20309 2/20 0.37
NAAA Q02083 2/20 0.35
EPHX1 P07099 2/20 0.33
MMP3 P08254 2/20 0.33
CYP19A1 P11511 4/20 0.33
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 1/20 0.30
HTT P42858 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
SCHEMBL9835433 0.98 NAAA (0.36) CHRM2CHRM4CHRM1CHRM3NAAA
SCHEMBL9836324 0.95 CHRM2 (0.38) CHRM2CHRM4CHRM1CHRM3NAAA
SCHEMBL9836376 0.88 CHRM2 (0.36) CHRM2CHRM4CHRM1CHRM3NAAA
SCHEMBL7389998 0.83 NAAA (0.37) CHRM2CHRM4CHRM1CHRM3NAAA
SCHEMBL9326867 0.71 CHRM2 (0.36) CHRM2CHRM4CHRM1CHRM3NAAA
SCHEMBL1777591 0.71 ALDH1A1 (0.48) CHRM2CHRM4CHRM1CHRM3SMN1; SMN2
SCHEMBL9325970 0.71 CHRM2 (0.36) CHRM2CHRM4CHRM1CHRM3NAAA
SCHEMBL9326863 0.71 CHRM2 (0.36) CHRM2CHRM4CHRM1CHRM3NAAA
SCHEMBL97374 0.70 NAAA (0.60) CHRM2CHRM4CHRM1CHRM3NAAA
SCHEMBL4056985 0.69 ALDH1A1 (0.42) CHRM2CHRM4CHRM1CHRM3CYP19A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed