SCHEMBL11153643

SCHEMBL11153643

O=C1CCCc2ccc(=O)[nH]c21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAOA P21397 2/20 0.41
MAOB P27338 2/20 0.41
CYP2A6 P11509 1/20 0.41
HCAR1 Q9BXC0 2/20 0.40
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
KDM4E B2RXH2 4/20 0.37
LMNA P02545 3/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 2/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 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
SCHEMBL1160085 0.74 MAOA (0.43) HSD17B10MEN1KMT2AMAOAMAOB
SCHEMBL4187867 0.74 HCAR1 (0.41) HSD17B10MAOAMAOBCYP2A6HCAR1
SCHEMBL6114558 0.71 CRBN (0.41) HCAR1CA12CA1CA3CA4
SCHEMBL18250040 0.70 MAOA (0.39) HSD17B10MEN1KMT2AMAOAMAOB
SCHEMBL3856824 0.70 ALDH1A1 (0.44) HSD17B10HCAR1GRIN2DGRIN3BGRIN1
Hydrochloric Acid SCHEMBL32680188 0.68 ALDH1A1 (0.43) HSD17B10HCAR1GRIN2DGRIN3BGRIN1
SCHEMBL928810 0.68 ALDH1A1 (0.43) HSD17B10HCAR1GRIN2DGRIN3BGRIN1
SCHEMBL9097365 0.67 CA12 (0.31) CA12CA1CA3CA4CA6
SCHEMBL4123765 0.67 ALOX15 (0.45) HSD17B10MEN1KMT2AMAOAMAOB
SCHEMBL866759 0.67 PKN1 (0.47) HSD17B10MEN1KMT2AMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0015543-B1 5,6,7,8-TETRAHYDRO-2,8-QUINOLINE DIONE AND PROCESS FOR ITS PREPARATION HOECHST AKTIENGESELLSCHAFT (DE) 1983-06-22 EP claimed
US-4277606-A 8-Oxo-5,6,7,8-tetrahydro-2-quinolone and process for the preparation thereof HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-07 US claimed
US-4277606-A 8-Oxo-5,6,7,8-tetrahydro-2-quinolone and process for the preparation thereof HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-07 US disclosed
US-4277606-A 8-Oxo-5,6,7,8-tetrahydro-2-quinolone and process for the preparation thereof HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-07 US disclosed
US-4277606-A 8-Oxo-5,6,7,8-tetrahydro-2-quinolone and process for the preparation thereof HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-07 US disclosed