SCHEMBL9819404

SCHEMBL9819404

CN1CCC(=O)N(c2ccccc2Cl)C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.47
BCL2A1 Q16548 1/20 0.47
ALOX5 P09917 2/20 0.44
ADRA1A P35348 2/20 0.43
ADRA1B P35368 2/20 0.43
ADRA1D P25100 1/20 0.43
ALDH1A1 P00352 4/20 0.42
MAPT P10636 3/20 0.42
POLB P06746 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
CASP1 P29466 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TP53 P04637 1/20 0.42
HTR1A P08908 1/20 0.41
PKM P14618 1/20 0.40
RAD51 Q06609 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 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
SCHEMBL9819237 0.88 BCL2A1 (0.49) BCL2A1ALDH1A1HTR1ARAD51
SCHEMBL11425493 0.87 MGLL (0.51) MGLLBCL2A1ALOX5ADRA1AADRA1B
SCHEMBL11272449 0.83 MGLL (0.50) MGLLBCL2A1ALOX5ADRA1AADRA1B
SCHEMBL11427213 0.83 BCL2A1 (0.44) MGLLBCL2A1ALOX5ADRA1AADRA1B
SCHEMBL9819424 0.81 BCL2A1 (0.49) BCL2A1ADRA1BALDH1A1MAPTHTR1A
SCHEMBL9819264 0.81 ADRA1B (0.47) BCL2A1ADRA1AADRA1BADRA1DALDH1A1
SCHEMBL9819256 0.81 MEN1 (0.47) MGLLALDH1A1MAPTPOLBHSD17B10
SCHEMBL11431742 0.80 OPRK1 (0.47) MGLLBCL2A1ALOX5ADRA1BMAPT
Hydrochloric Acid SCHEMBL9819442 0.79 ADRA2C (0.44) ALDH1A1MAPTPOLBL3MBTL1TP53
SCHEMBL3786268 0.79 MGLL (0.61) MGLLBCL2A1ALOX5ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0162669-B1 ANTICONVULSIVE COMPOUNDS KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-12-11 EP disclosed
US-4588729-A Treating convulsions with dihydrouracil derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1986-05-13 US disclosed
EP-0162669-A2 Anticonvulsive compounds KYOWA HAKKO KOGYO CO., LTD. (JP) 1985-11-27 EP disclosed