SCHEMBL8377115

SCHEMBL8377115

CNC(=O)C(CN1CCOCC1)N(C)C(=O)Oc1ccc2c(N)noc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ LTB4R Q15722 1/20 0.36
▸ LCK P06239 1/20 0.34
▸ CSF1R P07333 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ F9 P00740 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ IKBKE Q14164 1/20 0.33
▸ TBK1 Q9UHD2 1/20 0.33
▸ MMP1 P03956 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
SCHEMBL8381249 0.93 ALDH1A1 (0.36) MEN1KMT2AALDH1A1KDM4EEPHX2
SCHEMBL8377107 0.79 CYP1A2 (0.39) MAPK14LTB4RALDH1A1HPGDHSD17B10
SCHEMBL6651329 0.72 LTB4R (0.44) MEN1KMT2AMAPK14LTB4RALDH1A1
SCHEMBL8376040 0.72 DRD3 (0.40) ALDH1A1HPGDKDM4ENPC1EPHX2
SCHEMBL8375998 0.70 GAA (0.37) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL9212284 0.70 ALDH1A1 (0.43) KMT2AMAPK14LTB4RALDH1A1HPGD
SCHEMBL6651331 0.69 LTB4R (0.42) MEN1KMT2AMAPK14LTB4RALDH1A1
SCHEMBL3504561 0.69 ALDH1A1 (0.46) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL3505067 0.69 ACHE (0.40) ALDH1A1HPGDHSD17B10KDM4EHTR1A
SCHEMBL8377217 0.68 HTR2A (0.42) MEN1KMT2ADRD2HTR2AEPHX2

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-5925766-A COGNITION ACTIVATORS FOR DECREASING CHOLINERGIC FUNCTION OF ALZHEIMER*S DISEASE AND ARE ENZYME INHIBITORS OF MONOAMINE OXIDASE AND ARE ANTIDEPRESSANTS HOECHST MARION ROUSSEL, INC. (US) 1999-07-20 — — US disclosed
US-5756754-A Substituted 3-(aminoalkylamino)-1,2-benzisoxazoles and related compounds HOECHST MARION ROUSSEL, INC. (US) 1998-05-26 — — US disclosed
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