SCHEMBL7733302

SCHEMBL7733302

[CH]1CCCCCCCC1c1cccc2cc3ccccc3cc12

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
EPHX1 P07099 1/20 0.32
CHRM1 P11229 1/20 0.31
MAPT P10636 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
KDM1A O60341 1/20 0.30
NPC1 O15118 1/20 0.30

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
SCHEMBL7650798 0.83 KDM1A (0.44) ALDH1A1MAPTSMN1; SMN2KDM1ANPC1
SCHEMBL4721556 0.78 DRD2 (0.40) KDM4EALDH1A1GAAEPHX1
SCHEMBL1008916 0.78 KDM1A (0.46) ALDH1A1MAPTSMN1; SMN2KDM1ANPC1
SCHEMBL17090732 0.77 BCHE (0.35) KDM4EGAAMEN1KMT2A
SCHEMBL4722085 0.76 DRD2 (0.41) KDM4EALDH1A1GAACHRM1MAPT
SCHEMBL7732901 0.76 CYP1B1 (0.32) KDM4EALDH1A1GAAEPHX1
SCHEMBL27849970 0.74 ALDH1A1 (0.39) KDM4EALDH1A1GAAEPHX1
SCHEMBL29266777 0.73 ALDH1A1 (0.38) KDM4EALDH1A1GAAEPHX1
SCHEMBL4723104 0.73 SLC6A4 (0.41) KDM4EALDH1A1GAAMAPTMEN1
SCHEMBL4723997 0.72 SLC6A4 (0.42) KDM4EALDH1A1GAAMAPTMEN1

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-6410748-B1 Alicycli c group-containing monomer KABUSHIKI KAISHA TOSHIBA (JP) 2002-06-25 US disclosed
US-6291129-B1 LIGHT SENSITIVE ELEMENT WITH UNSATURATED POLYMERS KABUSHIKI KAISHA TOSHIBA (JP) 2001-09-18 US disclosed