SCHEMBL7747433

SCHEMBL7747433

CC(C)(C)OC(=O)NC(Sc1ccccc1)C(O[Si](C)(C)C(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 5/20 0.40
▸ CTSK P43235 4/20 0.40
▸ MMP13 P45452 1/20 0.39
▸ CTSL P07711 1/20 0.39
▸ CTSB P07858 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ PPARG P37231 3/20 0.38
▸ PPARA Q07869 3/20 0.38
▸ ATM Q13315 2/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ IDO1 P14902 1/20 0.37
▸ PPARD Q03181 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ MAPT P10636 1/20 0.37

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
SCHEMBL7743270 0.93 PPARA (0.41) CTSSCTSKMMP13CTSLCTSB
SCHEMBL7750575 0.93 PPARA (0.41) CTSSCTSKMMP13CTSLCTSB
SCHEMBL7747398 0.83 CTSS (0.46) CTSSCTSKMMP13CTSLCTSB
SCHEMBL7747789 0.77 L3MBTL1 (0.42) CTSLALDH1A1ATMMEN1KMT2A
SCHEMBL7747410 0.77 PPARA (0.45) CTSSCTSKMMP13CTSLCTSB
SCHEMBL7748907 0.77 PPARA (0.45) CTSSCTSKMMP13CTSLCTSB
SCHEMBL31477252 0.76 CTSK (0.43) CTSSCTSKCTSLALDH1A1ATM
SCHEMBL4179331 0.76 CTSK (0.44) CTSSCTSKCTSLCTSBPPARG
SCHEMBL7750570 0.74 CTSK (0.43) CTSSCTSKCTSLCTSBALDH1A1
SCHEMBL7743269 0.74 CTSK (0.43) CTSSCTSKCTSLCTSBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0776322-B1 METHOD FOR THE PREPARATION OF TAXOL AND ITS DERIVATIVES PHARMACIA & UPJOHN SPA (IT) 2001-11-07 — — EP disclosed
EP-1116718-A2 Method for the preparation of taxol and its derivatives PHARMACIA & UPJOHN S.p.A. (IT) 2001-07-18 — — EP disclosed
US-5767282-A Method for the preparation of taxol and its derivatives PHARMACIA & UPJOHN S.P.A. (IT) 1998-06-16 — — US disclosed
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