Sugi Predict

Sugi Predict / Compounds / SCHEMBL9544888

SCHEMBL9544888

SCHEMBL9544888

CC1(C)CC(NC(=O)NN)CC(C)(C)N1.CC1(C)CC(NCC(=O)NN)CC(C)(C)N1.CN1C(C)(C)CC(NC(=O)NN)CC1(C)C.CN1C(C)(C)CC(NCCC(=O)NN)CC1(C)C

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.37
▸ KMT2A Q03164 4/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ EZH2 Q15910 2/20 0.34
▸ POLB P06746 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ MEN1 O00255 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ ATM Q13315 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ GLA P06280 1/20 0.31

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
SCHEMBL8333479 0.82 POLB (0.40) KMT2AKDM4EPOLBHTTMEN1
SCHEMBL8338132 0.80 GAA (0.46) GAAKMT2AKDM4EEZH2POLB
SCHEMBL9301408 0.79 MEN1 (0.38) KMT2AKDM4EPOLBHTTMEN1
SCHEMBL8335975 0.78 GAA (0.44) GAAKMT2AKDM4EEZH2POLB
SCHEMBL10156196 0.75 GAA (0.39) GAAKMT2AKDM4EHTT
SCHEMBL8336929 0.75 HDAC4 (0.36) GAAKMT2AKDM4E
SCHEMBL311701 0.74 GAA (0.61) GAAKMT2AKDM4EEZH2POLB
SCHEMBL8335952 0.74 RECQL (0.50) GAAKMT2AKDM4EEZH2POLB
SCHEMBL9300620 0.73 HTT (0.41) GAAKDM4EPOLBHTTMAPT
SCHEMBL8334264 0.71 GAA (0.61) GAAKMT2AKDM4EPOLBHTT

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
WO-1993024935-A1 TELEPHONE CABLES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-12-09 — — WO disclosed