SCHEMBL7904254

SCHEMBL7904254

[CH2]COc1ccccc1[O]

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
MAPT P10636 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GLA P06280 1/20 0.35
KDM4E B2RXH2 2/20 0.33
NPC1 O15118 2/20 0.32
RECQL P46063 1/20 0.32
RAB9A P51151 1/20 0.32
GAA P10253 3/20 0.32
JAK2 O60674 1/20 0.32
LMNA P02545 1/20 0.32
HCRTR1 O43613 1/20 0.32
POLB P06746 2/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 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
SCHEMBL9584860 0.82 KDM4E (0.46) ALDH1A1SMN1; SMN2HPGDHTTL3MBTL1
SCHEMBL482954 0.78 ALDH1A1 (0.58) ALDH1A1L3MBTL1MAPTNPSR1GLA
SCHEMBL55705 0.78 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2HPGDHTTL3MBTL1
SCHEMBL7049447 0.76 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2HPGDHTTL3MBTL1
SCHEMBL6003548 0.76 DRD1 (0.46) ALDH1A1SMN1; SMN2HPGDHTTL3MBTL1
SCHEMBL4619630 0.76 ALDH1A1 (0.56) ALDH1A1HPGDL3MBTL1MAPTNPSR1
SCHEMBL3015617 0.76 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2HPGDHTTL3MBTL1
SCHEMBL8764972 0.76 KDM4E (0.43) ALDH1A1SMN1; SMN2HPGDHTTL3MBTL1
SCHEMBL3683087 0.76 LIG1 (0.53) ALDH1A1HPGDL3MBTL1MAPTKDM4E
SCHEMBL7055886 0.74 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2HPGDHTTL3MBTL1

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-1756237-B1 LATEX-ENCAPSULATED PARTICULATES FOR INK-JET APPLICATIONS HEWLETT PACKARD DEVELOPMENT CO LP (US) 2017-05-03 EP claimed
EP-1094826-A1 NOVEL THERAPEUTIC AGENTS THAT MODULATE ALPHA-1A ADRENERGIC RECEPTORS Advanced Medicine, Inc. (US) 2001-05-02 EP disclosed
WO-1999064042-A1 NOVEL THERAPEUTIC AGENTS THAT MODULATE ALPHA-1A ADRENERGIC RECEPTORS ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed