SCHEMBL8668534

SCHEMBL8668534

O=C(C1CC(S(=O)(=O)c2ccccc2)C(c2ccccc2F)N1)N1CCCc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 2/20 0.46
TSHR P16473 1/20 0.46
POLB P06746 1/20 0.43
ATM Q13315 1/20 0.42
GAA P10253 1/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
NPSR1 Q6W5P4 1/20 0.40
USP2 O75604 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL8668250 0.84 POLB (0.46) SMN1; SMN2HTTPOLBATMKMT2A
SCHEMBL8665662 0.82 HDAC2 (0.40) SMN1; SMN2LMNAPOLBGAAKMT2A
SCHEMBL8871034 0.78 KMT2A (0.38) LMNATSHRPOLBKMT2AMEN1
SCHEMBL8666857 0.78 KMT2A (0.38) LMNATSHRPOLBKMT2AMEN1
SCHEMBL8666837 0.78 HTT (0.43) SMN1; SMN2HTTPOLBGAAKMT2A
Hydrochloric Acid SCHEMBL8666991 0.78 KMT2A (0.37) LMNATSHRPOLBKMT2AMEN1
SCHEMBL8666307 0.76 GRM5 (0.38) SMN1; SMN2LMNATSHRGAAKMT2A
SCHEMBL8670259 0.74 SMYD3 (0.36) POLBGAAKMT2AMEN1L3MBTL1
SCHEMBL8685324 0.72 L3MBTL1 (0.38) POLBATMKMT2AMEN1USP2
SCHEMBL8689402 0.72 MEN1 (0.35) LMNAHTTPOLBKMT2AMEN1

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