SCHEMBL10444444

SCHEMBL10444444

CCCCCCCCCCCCCCCCCCCCCCc1ccc(Sc2cccc3c2C(=O)c2c(Sc4ccc(CCCCCCCCCCCCCCCCCCCCCC)cc4N)cccc2C3=O)c(N)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 6/20 0.42
▸ SLC6A4 P31645 6/20 0.42
▸ ELANE P08246 5/20 0.42
▸ CTSG P08311 3/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ NSD2 O96028 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ GPR3 P46089 1/20 0.39
▸ DHFR P00374 1/20 0.39

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
SCHEMBL10444443 1.00 SLC6A2 (0.42) SLC6A2SLC6A4ELANECTSGKDM4E
SCHEMBL10444640 1.00 SLC6A2 (0.42) SLC6A2SLC6A4ELANECTSGKDM4E
SCHEMBL10444663 1.00 SLC6A2 (0.42) SLC6A2SLC6A4ELANECTSGKDM4E
SCHEMBL10444667 1.00 SLC6A2 (0.42) SLC6A2SLC6A4ELANECTSGKDM4E
SCHEMBL10444625 1.00 SLC6A2 (0.42) SLC6A2SLC6A4ELANECTSGKDM4E
SCHEMBL10444442 1.00 SLC6A2 (0.42) SLC6A2SLC6A4ELANECTSGKDM4E
SCHEMBL10444814 1.00 SLC6A2 (0.42) SLC6A2SLC6A4ELANECTSGKDM4E
SCHEMBL10444627 1.00 SLC6A2 (0.42) SLC6A2SLC6A4ELANECTSGKDM4E
SCHEMBL10444609 1.00 SLC6A2 (0.42) SLC6A2SLC6A4ELANECTSGKDM4E
SCHEMBL10444414 1.00 SLC6A2 (0.42) SLC6A2SLC6A4ELANECTSGKDM4E

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
EP-0371782-A2 Anthraquinone compound, polymerizable dyestuff monomer derived therefrom and resin and color toner composition MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-06-06 — — EP disclosed
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