SCHEMBL11260128

SCHEMBL11260128

O=C1CC(c2ccc(Cl)cc2)CC(=O)N1c1ccncc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
MAPT P10636 3/20 0.53
ALOX12 P18054 2/20 0.53
GAA P10253 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.43
HSD17B10 Q99714 2/20 0.43
POLB P06746 1/20 0.43
HTT P42858 1/20 0.43
TP53 P04637 1/20 0.43
SRD5A1 P18405 1/20 0.41
BCHE P06276 1/20 0.41
ADRA1A P35348 3/20 0.40
ADRA1D P25100 2/20 0.40
ADRA1B P35368 2/20 0.40
KMT2A Q03164 2/20 0.40
MAP1LC3B Q9GZQ8 1/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 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
SCHEMBL11254480 0.84 MEN1 (0.54) ALDH1A1MAPTGAASMN1; SMN2HSD17B10
SCHEMBL11261064 0.81 ALDH1A1 (0.56) ALDH1A1MAPTGAASMN1; SMN2POLB
SCHEMBL30444127 0.76 TACR3 (0.40) ALDH1A1MAPTALOX12GAATP53
SCHEMBL25256653 0.74 MAPK11 (0.43) ALDH1A1MAPTALOX12GAATP53
SCHEMBL3036220 0.74 ALDH1A1 (0.58) ALDH1A1MAPTGAAPOLBHPGD
SCHEMBL31560228 0.74 HSD11B1 (0.38) ALDH1A1MAPTALOX12GAASMN1; SMN2
SCHEMBL11266599 0.69 BCHE (0.58) ALDH1A1SMN1; SMN2POLBBCHEKMT2A
SCHEMBL425308 0.69 POLB (0.58) ALDH1A1MAPTALOX12GAASMN1; SMN2
SCHEMBL8877725 0.69 L3MBTL1 (0.69) ALDH1A1SMN1; SMN2HSD17B10KMT2AMEN1
SCHEMBL11252258 0.67 USP2 (0.47) ALDH1A1MAPTALOX12GAASMN1; SMN2

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
US-4309541-A CHEMICAL INTERMEDIATES TO QUINAZOLINE HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1982-01-05 US disclosed
US-4255429-A HYPOTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1981-03-10 US disclosed
EP-0009465-A1 N-(1-(4-amino-2-quinazolinyl)-3 or 4-piperidyl lactames, process for their preparation and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1980-04-02 EP disclosed