SCHEMBL9667995

SCHEMBL9667995

O=C(CN1CCCC1=O)N1CCN(C(=O)CN2CC(c3ccc(Cl)cc3)CC2=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TP53 P04637 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 2/20 0.41
EPHX2 P34913 1/20 0.41
USP19 O94966 2/20 0.41
TSHR P16473 2/20 0.40
HPGD P15428 1/20 0.40
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
TLR8 Q9NR97 1/20 0.39
TLR7 Q9NYK1 1/20 0.39
DRD4 P21917 1/20 0.39

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
SCHEMBL9669910 0.86 KDM1A (0.47) KMT2ATP53USP19TSHRHPGD
Hydrochloric Acid SCHEMBL9669646 0.85 KDM1A (0.46) KMT2ATP53USP19TSHRHPGD
SCHEMBL9668039 0.84 TP53 (0.44) TP53SMN1; SMN2ALDH1A1USP19TSHR
SCHEMBL10405021 0.81 HPGD (0.54) MEN1KMT2ATP53SMN1; SMN2ALDH1A1
SCHEMBL9668346 0.81 P2RX7 (0.45) TP53SMN1; SMN2ALDH1A1USP19TSHR
Cebaracetam SCHEMBL141165 0.78 MDM2 (0.46) TP53SMN1; SMN2USP19TSHRHPGD
SCHEMBL9669356 0.78 TP53 (0.54) TP53SMN1; SMN2ALDH1A1TSHRHPGD
Fumaric Acid SCHEMBL10405329 0.77 DRD4 (0.49) MEN1KMT2ATP53SMN1; SMN2ALDH1A1
Maleic Acid SCHEMBL9670470 0.77 DRD4 (0.49) MEN1KMT2ATP53SMN1; SMN2ALDH1A1
SCHEMBL11239159 0.75 TSHR (0.63) MEN1KMT2AALDH1A1TSHRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0236263-B1 SUBSTITUTED PYRROLIDINONES CIBA-GEIGY AG (CH) 1992-12-30 EP claimed
US-4945092-A Substituted 1-(oxopyrrolidinylalkanoyl)-piperazines useful as nootropics CIBA-GEIGY CORPORATION (US) 1990-07-31 US claimed
EP-0236263-A2 Substituted pyrrolidinones CIBA-GEIGY AG (CH) 1987-09-09 EP claimed
EP-0236263-B1 SUBSTITUTED PYRROLIDINONES CIBA-GEIGY AG (CH) 1992-12-30 EP disclosed
US-4945092-A Substituted 1-(oxopyrrolidinylalkanoyl)-piperazines useful as nootropics CIBA-GEIGY CORPORATION (US) 1990-07-31 US disclosed
EP-0236263-A2 Substituted pyrrolidinones CIBA-GEIGY AG (CH) 1987-09-09 EP disclosed