SCHEMBL7197015

SCHEMBL7197015

CCCCCCCCC/C(=N\O)c1ccc(Sc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.54
▸ LMNA P02545 2/20 0.54
▸ USP2 O75604 1/20 0.54
▸ ALOX15 P16050 1/20 0.54
▸ ALOX12 P18054 1/20 0.54
▸ HTT P42858 1/20 0.54
▸ NPC1 O15118 1/20 0.54
▸ HSP90AA1 P07900 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ MGLL Q99685 7/20 0.48
▸ HDAC8 Q9BY41 2/20 0.47
▸ MAPT P10636 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ CES2 O00748 2/20 0.42

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
SCHEMBL7197017 1.00 KDM4E (0.54) KDM4ELMNAUSP2ALOX15ALOX12
SCHEMBL28362058 1.00 KDM4E (0.54) KDM4ELMNAUSP2ALOX15ALOX12
SCHEMBL22550003 0.92 KDM4E (0.49) KDM4ELMNAUSP2ALOX15ALOX12
SCHEMBL25369969 0.88 ALDH1A1 (0.47) KDM4ELMNAUSP2ALOX15ALOX12
SCHEMBL10783627 0.86 KDM4E (0.59) KDM4ELMNAUSP2ALOX15ALOX12
SCHEMBL8903696 0.86 KDM4E (0.59) KDM4ELMNAUSP2ALOX15ALOX12
SCHEMBL10783630 0.86 KDM4E (0.59) KDM4ELMNAUSP2ALOX15ALOX12
SCHEMBL7924687 0.86 KDM4E (0.59) KDM4ELMNAUSP2ALOX15ALOX12
SCHEMBL7984521 0.86 KDM4E (0.59) KDM4ELMNAUSP2ALOX15ALOX12
SCHEMBL7418674 0.86 KDM4E (0.59) KDM4ELMNAUSP2ALOX15ALOX12

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-6596445-B1 Initiators for photopolymerization of radically polymerizable compounds CIBA SPECIALTY CHEMICALS CORPORATION 2003-07-22 — — US disclosed
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