SCHEMBL7577670

SCHEMBL7577670

C=CCOC(=O)C1OC1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.38
MAPT P10636 4/20 0.36
CYP3A4 P08684 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
GAA P10253 4/20 0.33
RECQL P46063 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 2/20 0.33
ALDH1A1 P00352 4/20 0.32
HSD17B10 Q99714 2/20 0.32
TP53 P04637 2/20 0.32
KDM4E B2RXH2 2/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL712837 0.85 CYP3A4 (0.39) TSHRMAPTCYP3A4TDP1CACNA1B
SCHEMBL19155610 0.83 FUCA1 (0.33) TSHRMAPTCYP3A4TDP1GAA
SCHEMBL20253754 0.79 TSHR (0.33) TSHRMAPTCYP3A4TDP1GAA
SCHEMBL20253599 0.79 ERN1 (0.35) TSHRMAPTCYP3A4TDP1GAA
Hydrochloric Acid SCHEMBL11188101 0.78 SUCNR1 (0.46) TSHRMAPTCYP3A4TDP1CACNA1B
SCHEMBL7575246 0.77 CYP3A4 (0.34) TSHRMAPTCYP3A4TDP1CACNA1B
SCHEMBL9436542 0.77 CYP3A4 (0.34) TSHRMAPTCYP3A4TDP1CACNA1B
SCHEMBL2175986 0.76 TSHR (0.36) TSHRALDH1A1
SCHEMBL20253786 0.76 CYP3A4 (0.36) TSHRMAPTCYP3A4TDP1CACNA1B
SCHEMBL20253751 0.76 CYP3A4 (0.36) TSHRMAPTCYP3A4TDP1CACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101898993-A Preparation method of 4-hydroxyl ketopyrrolidine-2-acetamide YUAN DI 2010-12-01 CN disclosed
US-20020042055-A1 Alteration of hydrolase genes and screening of the resulting libraries for the ability to catalyze specific reactions MAXYGEN, INC. 2002-04-11 US disclosed
WO-2001046476-A1 ALTERATION OF HYDROLASE GENES AND SCREENING OF THE RESULTING LIBRARIES FOR THE ABILITY TO CATALYZE SPECIFIC REACTIONS MAXYGEN, INC. (US) 2001-06-28 WO disclosed
US-5721018-A Method for producing multilayer coatings HERBERTS GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-02-24 US disclosed
US-5395659-A Cationic polymers, clear coats, automobiles HERBERTS GMBH (DE) 1995-03-07 US disclosed
US-4909915-A Water dilutable poly (meth)acrylate containing ionic groups HERBERTS GESELLSCHAFT MIT BESCHRANKTER (DE) 1990-03-20 US disclosed
US-4865705-A Non-auto crosslinking binder combination, aqueous coating compound containing the same and its use HERBERTS GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-09-12 US disclosed
CN-87105631-A Non-auto crosslinking binder combination and the aqueous coating and the application thereof that contain this mixture 1988-03-02 CN disclosed
CN-87105636-A The non-self-crosslinking adhesive composition contains the water japanning liquid and the application thereof of this binder composition 1988-03-02 CN disclosed