SCHEMBL6608029

SCHEMBL6608029

CCOC(=O)C(Cl)C(O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.51
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
PIN1 Q13526 1/20 0.47
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
TSHR P16473 2/20 0.44
POLB P06746 1/20 0.44
GAA P10253 2/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL30862344 1.00 MMP8 (0.51) MMP8MEN1NPC1KMT2ASMN1; SMN2
SCHEMBL14130590 0.86 MMP8 (0.54) MMP8MEN1NPC1KMT2ASMN1; SMN2
SCHEMBL606117 0.86 MMP8 (0.54) MMP8MEN1NPC1KMT2ASMN1; SMN2
SCHEMBL23342965 0.86 MMP8 (0.54) MMP8MEN1NPC1KMT2ASMN1; SMN2
SCHEMBL11938487 0.86 MMP8 (0.54) MMP8MEN1NPC1KMT2ASMN1; SMN2
SCHEMBL8926506 0.84 MMP8 (0.53) MMP8MEN1NPC1KMT2ASMN1; SMN2
SCHEMBL9126861 0.82 MMP8 (0.54) MMP8MEN1NPC1KMT2ASMN1; SMN2
SCHEMBL31556283 0.82 KMT2A (0.58) MEN1KMT2AMAPTTSHRPOLB
SCHEMBL8776709 0.82 ALOX15 (0.49) MEN1NPC1KMT2ASMN1; SMN2MAPT
SCHEMBL8776680 0.82 ALOX15 (0.49) MEN1NPC1KMT2ASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1568701-B1 TRANSITION METAL COMPLEX HAVING DIPHOSPHINE COMPLEX AS LIGAND TAKEDA PHARMACEUTICAL (JP) 2010-01-20 EP disclosed
EP-1114815-B1 Process to prepare taxol UPJOHN CO (US) 2004-09-29 EP disclosed
EP-1352900-A1 Process to prepare taxol PHARMACIA & UPJOHN COMPANY (US) 2003-10-15 EP disclosed
EP-1352899-A1 Process to prepare taxol PHARMACIA & UPJOHN COMPANY (US) 2003-10-15 EP disclosed
EP-0912504-B1 Oxazolidine ester UPJOHN CO (US) 2002-09-11 EP disclosed
US-6307064-B1 PHENYLISOSERINE ESTER OF SILYLATED BACCATIN III PHARMACIA & UPJOHN COMPANY 2001-10-23 US disclosed
EP-1114815-A2 Process to prepare taxol PHARMACIA & UPJOHN COMPANY (US) 2001-07-11 EP disclosed
US-6177573-B1 Process to prepare taxol PHARMACIA & UPJOHN COMPANY 2001-01-23 US disclosed
US-6057452-A Process to prepare taxol PHARMACIA & UPJOHN COMPANY 2000-05-02 US disclosed
EP-0912504-A1 PROCESS TO PREPARE TAXOL PHARMACIA & UPJOHN COMPANY (US) 1999-05-06 EP disclosed
CN-1216039-A Process for preparing taxol UPJOHN CO (US) 1999-05-05 CN disclosed
WO-1997042167-A1 PROCESS TO PREPARE TAXOL PHARMACIA & UPJOHN COMPANY (US) 1997-11-13 WO disclosed