Sugi Predict

Sugi Predict / Compounds / SCHEMBL984701

SCHEMBL984701

SCHEMBL984701

CC(=O)NC1CC(C)(C)NC(C)(C)C1.CC(=O)NC1CC(C)(C)NC(C)(C)C1.CC(=O)NC1CC(C)(C)NC(C)(C)C1.CC(=O)NC1CC(C)(C)NC(C)(C)C1.CC(=O)NC1CC(C)(C)NC(C)(C)C1.O=P(O)(O)C(N(CCN(C(P(=O)(O)O)P(=O)(O)O)C(P(=O)(O)O)P(=O)(O)O)CCN(C(P(=O)(O)O)P(=O)(O)O)C(P(=O)(O)O)P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.38
▸ HTT P42858 1/20 0.38
▸ GAA P10253 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ EZH2 Q15910 1/20 0.36
▸ FDPS P14324 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ ATM Q13315 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ RECQL P46063 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34

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
SCHEMBL986386 0.84 FDPS (0.35) FDPS
SCHEMBL986669 0.84 KDM4E (0.38) GAAFDPSKMT2AKDM4E
SCHEMBL984648 0.82 FDPS (0.41) FDPS
SCHEMBL3797792 0.77 — —
SCHEMBL77511 0.75 RECQL (0.55) POLBHTTGAAALDH1A1EZH2
SCHEMBL987119 0.74 FDPS (0.41) FDPS
SCHEMBL29453034 0.73 RECQL (0.53) POLBHTTGAAALDH1A1EZH2
SCHEMBL4161658 0.73 — —
SCHEMBL6740726 0.70 FDPS (0.60) FDPSHSD17B10KDM4E
SCHEMBL10945040 0.70 FDPS (0.60) FDPSHSD17B10KDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7862746-B2 Stabilization of natural composites BASF SE. (DE) 2011-01-04 — — US claimed
WO-2006087269-A1 STABILIZATION OF NATURAL COMPOSITES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-08-24 — — WO claimed
US-20060183821-A1 Stabilization of natural composites CIBA CORPORATION 2006-08-17 — — US claimed
US-7862746-B2 Stabilization of natural composites BASF SE. (DE) 2011-01-04 — — US disclosed
US-20060183821-A1 Stabilization of natural composites CIBA CORPORATION 2006-08-17 — — US disclosed