SCHEMBL7731849

SCHEMBL7731849

CCOC(C)CNc1ccccc1NCC(C)OCC

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 1/20 0.37
▸ PDE3A Q14432 1/20 0.37
▸ NAMPT P43490 1/20 0.36
▸ IDO1 P14902 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MAPT P10636 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ NLRP3 Q96P20 1/20 0.33
▸ LMNA P02545 2/20 0.32
▸ MTNR1A P48039 1/20 0.32
▸ MTNR1B P49286 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL10408186 0.89 MAPT (0.50) KMT2AMAPTHTTLMNAGAA
SCHEMBL7731844 0.79 ALDH1A1 (0.38) PDE3BPDE3ANAMPTL3MBTL1KMT2A
SCHEMBL7731840 0.79 IDO1 (0.38) PDE3BPDE3AIDO1L3MBTL1KDM4E
SCHEMBL6249635 0.73 IDO1 (0.57) IDO1L3MBTL1KDM4EKMT2AMAPT
SCHEMBL23812177 0.72 PDE3B (0.36) PDE3BPDE3AGAA
SCHEMBL18496370 0.72 AAK1 (0.38) PDE3BPDE3AL3MBTL1KDM4EKMT2A
SCHEMBL18496333 0.72 AAK1 (0.38) PDE3BPDE3AL3MBTL1KDM4EKMT2A
SCHEMBL23812180 0.72 PDE3B (0.36) PDE3BPDE3AGAA
SCHEMBL18496373 0.72 AAK1 (0.38) PDE3BPDE3AL3MBTL1KDM4EKMT2A
SCHEMBL26871641 0.72 SMN1; SMN2 (0.47) KMT2AMAPTHTTGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6399272-B1 Phenylenediamine derivative-type additive useful for a chemically amplified photoresist HYUNDAI ELECTRONICS INDUSTRIES CO., LTD. (KR) 2002-06-04 — — US disclosed
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