SCHEMBL6060454

SCHEMBL6060454

Cc1ccc2c(c1)n(CC(C)O)c(=O)n2CC(C)O

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.41
▸ ALDH1A1 P00352 3/20 0.39
▸ MAPT P10636 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ DAO P14920 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ CACNA1B Q00975 2/20 0.38
▸ PRMT5 O14744 2/20 0.37
▸ WDR77 Q9BQA1 2/20 0.37
▸ HPD P32754 1/20 0.37
▸ AGER Q15109 1/20 0.37
▸ BRD4 O60885 1/20 0.37
▸ HTR2A P28223 2/20 0.36
▸ HTR2C P28335 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36

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
SCHEMBL6059436 0.84 MEN1 (0.49) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL11838187 0.83 KMT2A (0.45) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL11598806 0.80 AGER (0.53) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL6060147 0.80 SMN1; SMN2 (0.48) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL15489554 0.77 HSD17B10 (0.45) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL6060518 0.76 KMT2A (0.50) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL6060306 0.75 DAO (0.60) MEN1KMT2AKDM4EALDH1A1DAO
SCHEMBL25886216 0.74 MEN1 (0.55) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL6059612 0.73 MEN1 (0.51) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL260676 0.73 KDM4E (0.43) KDM4EALDH1A1MAPTMAPK1

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-20060155096-A1 Thermoplastic polymer, thermoplastic polymer composition, antistatic agent, and resin composition MITSUI TAKEDA CHEMICALS, INC. (JP) 2006-07-13 — — US disclosed
EP-1541608-A1 THERMOPLASTIC POLYMER, THERMOPLASTIC POLYMER COMPOSITION, ANTISTATIC AGENT, AND RESIN COMPOSITION MITSUI TAKEDA CHEMICALS, INC. (JP) 2005-06-15 — — EP disclosed
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