SCHEMBL9802990

SCHEMBL9802990

O=C1CCCc2[nH]c(=O)c3c(c21)CCC3

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.57
ALOX15 P16050 1/20 0.57
ALDH1A1 P00352 2/20 0.50
MAPT P10636 2/20 0.50
PTK2 Q05397 1/20 0.43
TSHR P16473 2/20 0.40
DYRK1A Q13627 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PARP1 P09874 2/20 0.39
BRD4 O60885 6/20 0.37
PDE9A O76083 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
USP2 O75604 1/20 0.33
LMNA P02545 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
SCHEMBL9803418 0.98 SMN1; SMN2 (0.61) SMN1; SMN2ALOX15ALDH1A1MAPTPTK2
SCHEMBL5462185 0.81 SMN1; SMN2 (0.48) SMN1; SMN2ALOX15ALDH1A1MAPTPTK2
SCHEMBL23537463 0.81 SMN1; SMN2 (0.42) SMN1; SMN2ALOX15ALDH1A1MAPTPTK2
SCHEMBL23537289 0.81 SMN1; SMN2 (0.38) SMN1; SMN2ALOX15ALDH1A1MAPTPTK2
SCHEMBL21963156 0.78 ALOX15 (0.91) SMN1; SMN2ALOX15ALDH1A1MAPTTSHR
SCHEMBL9802964 0.73 PTK2 (0.59) SMN1; SMN2ALOX15ALDH1A1MAPTPTK2
SCHEMBL23537356 0.69 PARP1 (0.59) SMN1; SMN2ALOX15ALDH1A1MAPTPTK2
SCHEMBL29824193 0.69 PARP1 (0.59) SMN1; SMN2ALOX15ALDH1A1MAPTPTK2
SCHEMBL23537608 0.67 DYRK1A (0.44) PTK2TSHRDYRK1AL3MBTL1PARP1
SCHEMBL3109830 0.67 ALDH1A1 (1.00) SMN1; SMN2ALOX15ALDH1A1MAPTTSHR

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
US-5068334-A Analgesics and antipyretics KARL THOMAE GMBH (DE) 1991-11-26 US disclosed
EP-0338228-A2 Use of quinoline-2,5-diones in a medicament having an analgesic, antipyretic and/or antiphlogistic activity Dr. Karl Thomae GmbH (DE) 1989-10-25 EP disclosed