SCHEMBL8665746

SCHEMBL8665746

O=C(O)C1CC(C(=O)N2CCOCC2)NC1c1ccccc1F

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 3/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.39
FKBP1A P62942 1/20 0.39
GAA P10253 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
KMT2A Q03164 2/20 0.38
PHGDH O43175 1/20 0.38
CNR1 P21554 1/20 0.38
TSHR P16473 2/20 0.38
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
PRCP P42785 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL8666837 0.82 HTT (0.43) ALDH1A1KDM4EHPGDHSD17B10FKBP1A
SCHEMBL8668679 0.81 MEN1 (0.43) ALDH1A1GAAKMT2ATSHR
Hydrochloric Acid SCHEMBL8672045 0.80 MEN1 (0.42) ALDH1A1GAAKMT2ATSHR
SCHEMBL8672057 0.80 GRM5 (0.39) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL8668250 0.75 POLB (0.46) KMT2APOLBHTTSMN1; SMN2ATM
Hydrochloric Acid SCHEMBL8683994 0.73 SMN1; SMN2 (0.38) ALDH1A1HSD17B10TSHRPOLBSMN1; SMN2
SCHEMBL8666843 0.72 MEN1 (0.38) ALDH1A1GAAKMT2A
SCHEMBL8669627 0.72 KMT2A (0.40) GAAKMT2ATSHR
SCHEMBL8665662 0.71 HDAC2 (0.40) KDM4EHPGDGAAKMT2APOLB
SCHEMBL8666356 0.70 LMNA (0.41) ALDH1A1HPGDKMT2A

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-5707991-A TREATMENT OF NERVOUS SYSTEM DISORDERS, PARKINSON'S DISEASE RHONE-POULENC RORER S.A. (FR) 1998-01-13 US disclosed