SCHEMBL9257413

SCHEMBL9257413

O=C(Nc1ccncc1S(=O)(=O)NC(=O)C1CCCC1)C1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BRS3 P32247 11/20 0.52
▸ HDAC3 O15379 3/20 0.46
▸ HDAC1 Q13547 3/20 0.46
▸ HDAC2 Q92769 3/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ NAMPT P43490 1/20 0.44
▸ CETP P11597 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL9259585 0.85 BRS3 (0.45) BRS3HDAC3HDAC1HDAC2ALDH1A1
SCHEMBL8556962 0.75 HDAC3 (0.45) HDAC3HDAC1HDAC2MEN1ALDH1A1
SCHEMBL16568954 0.75 KMT2A (0.54) HDAC3HDAC1HDAC2ALDH1A1GAA
SCHEMBL30785575 0.73 GAA (0.55) HDAC3HDAC1HDAC2GAAKMT2A
SCHEMBL9367046 0.73 BRS3 (0.73) BRS3MEN1KMT2A
SCHEMBL9367824 0.73 BRS3 (0.73) BRS3MEN1KMT2A
SCHEMBL20160888 0.72 GSK3B (0.60) HDAC3HDAC1HDAC2MEN1GAA
Hydrochloric Acid SCHEMBL18208874 0.71 GSK3B (0.59) HDAC3HDAC1HDAC2MEN1GAA
SCHEMBL9370827 0.71 BRS3 (0.77) BRS3ALDH1A1GAALMNATSHR
SCHEMBL9366479 0.71 BRS3 (0.77) BRS3ALDH1A1GAALMNATSHR

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-5459138-A Dysfunctions of glutamatergic neurotransmission associated with learning and memory ADIR ET COMPAGNIE (FR) 1995-10-17 — — US disclosed
Send feedback