SCHEMBL7815359

SCHEMBL7815359

CCCC(=O)OC1CCC(F)CC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.51
ALDH1A1 P00352 2/20 0.41
EPHX1 P07099 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
CYP19A1 P11511 2/20 0.36
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 2/20 0.34
TSHR P16473 1/20 0.34
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
SLC18A3 Q16572 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL8690677 0.90
SCHEMBL10929263 0.84 NAAA (0.55) NAAAALDH1A1EPHX1SMN1; SMN2CYP19A1
SCHEMBL10929265 0.84 NAAA (0.55) NAAAALDH1A1EPHX1SMN1; SMN2CYP19A1
SCHEMBL28305046 0.82 NAAA (0.53) NAAAALDH1A1EPHX1SMN1; SMN2CYP19A1
SCHEMBL27801372 0.82 NAAA (0.53) NAAAALDH1A1EPHX1SMN1; SMN2CYP19A1
SCHEMBL1695592 0.82 NAAA (0.72) NAAAALDH1A1EPHX1SMN1; SMN2CYP19A1
SCHEMBL2433610 0.82 NAAA (0.67) NAAAALDH1A1EPHX1SMN1; SMN2CYP19A1
Hydrochloric Acid SCHEMBL28131564 0.81 NAAA (0.51) NAAAALDH1A1EPHX1SMN1; SMN2CYP19A1
SCHEMBL2201247 0.81 NAAA (0.51) NAAAALDH1A1EPHX1SMN1; SMN2HTT
Hydrochloric Acid SCHEMBL32662253 0.80 NAAA (0.70) NAAAALDH1A1EPHX1SMN1; SMN2CYP19A1

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
EP-1112268-A1 CONDENSED HETEROCYCLIC COMPOUNDS AND HERBICIDES CONTAINING THEM SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2001-07-04 EP disclosed
WO-2000015633-A1 CONDENSED HETEROCYLIC COMPOUNDS AND HERBICIDES CONTAINING THEM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-03-23 WO disclosed