SCHEMBL9768576

SCHEMBL9768576

O=c1[nH]cc(-c2ccc(F)cc2)n1CCCCl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PGR P06401 2/20 0.36
MAPK14 Q16539 3/20 0.35
ADRA1A P35348 4/20 0.35
ADRA1B P35368 4/20 0.35
ADRA1D P25100 3/20 0.35
KDM4E B2RXH2 2/20 0.34
HSD17B10 Q99714 2/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
GRIN1 Q05586 2/20 0.34
GRIN2B Q13224 2/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
GABRP O00591 1/20 0.34

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
SCHEMBL9768587 0.91 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2PGRMAPK14KDM4E
SCHEMBL9768675 0.76 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2KDM4EHSD17B10KMT2A
SCHEMBL17446072 0.69 ALDH1A1 (0.51) ALDH1A1PGRKDM4EHSD17B10KMT2A
SCHEMBL3792986 0.68 SLC9A1 (0.47) ADRA1AADRA1BADRA1D
SCHEMBL7822379 0.68 ADRA1A (0.50) ADRA1AADRA1BADRA1D
SCHEMBL4500559 0.67 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2PGRKDM4EKMT2A
SCHEMBL7833004 0.67 ADRA1D (0.43) ADRA1AADRA1BADRA1D
SCHEMBL11255916 0.65 FABP4 (0.54) ALDH1A1KDM4EHSD17B10KMT2AGLA
SCHEMBL11267074 0.65 FABP4 (0.54) ALDH1A1KDM4EHSD17B10KMT2AGLA
SCHEMBL11258884 0.65 FABP4 (0.54) ALDH1A1KDM4EHSD17B10KMT2AGLA

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-5059601-A IMIDAZOLONE DERIVATIVES WITH ACTIVITY ON CENTRAL NERVOUS SYSTEM AND ANTIHYPERTENSIVE ACTIVITY, PREPARATION METHODS THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ISTITUTO LUSOFARMACO D'ITALIA S.P.A. (IT) 1991-10-22 US disclosed
EP-0379990-A1 Imidazolone derivatives with activity on central nervous system and antihypertensive activity, preparation methods thereof, and pharmaceutical compositions containing them ISTITUTO LUSO FARMACO D'ITALIA S.p.A. (IT) 1990-08-01 EP disclosed