SCHEMBL10444619

SCHEMBL10444619

Cc1ccc(Sc2cccc3c2C(=O)c2c(Sc4ccc(C)cc4N)cccc2C3=O)c(N)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 8/20 0.51
▸ SLC6A3 Q01959 7/20 0.51
▸ SLC6A2 P23975 7/20 0.51
▸ MAPK1 P28482 4/20 0.50
▸ KDM4E B2RXH2 3/20 0.50
▸ MAPT P10636 3/20 0.50
▸ NSD2 O96028 1/20 0.50
▸ TDP1 Q9NUW8 3/20 0.48
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ ELANE P08246 2/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ CYP3A4 P08684 3/20 0.40
▸ TSHR P16473 2/20 0.40
▸ ADORA2A P29274 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ BRCA1 P38398 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL10444623 0.82 KDM4E (0.50) SLC6A4SLC6A3SLC6A2MAPK1KDM4E
SCHEMBL10444670 0.82 MAPK1 (0.50) SLC6A4SLC6A3SLC6A2MAPK1KDM4E
SCHEMBL10444716 0.82 SLC6A4 (0.52) SLC6A4SLC6A3SLC6A2MAPK1KDM4E
SCHEMBL10444730 0.82 SLC6A2 (0.51) SLC6A4SLC6A3SLC6A2MAPK1KDM4E
SCHEMBL10444626 0.82 MAPK1 (0.47) SLC6A4SLC6A3SLC6A2MAPK1KDM4E
SCHEMBL10339614 0.81 MAPT (0.64) SLC6A4SLC6A3SLC6A2MAPK1KDM4E
SCHEMBL10444668 0.80 KDM4E (0.44) SLC6A4SLC6A3SLC6A2MAPK1KDM4E
SCHEMBL10444809 0.79 MAPK1 (0.50) MAPK1KDM4EMAPTNSD2TDP1
SCHEMBL10444709 0.79 MAPT (0.43) SLC6A4SLC6A3SLC6A2MAPK1KDM4E
SCHEMBL10444707 0.79 MAPT (0.43) SLC6A4SLC6A3SLC6A2MAPK1KDM4E

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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