SCHEMBL8448332

SCHEMBL8448332

C=C(C)C(=O)NCC(C)OC(=O)OCOC(C)=O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.32
MTNR1B P49286 3/20 0.32
TSHR P16473 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL9399525 0.89 TSHR (0.34) MTNR1AMTNR1BTSHR
SCHEMBL8447931 0.83 MTNR1A (0.33) MTNR1AMTNR1BTSHR
SCHEMBL8447280 0.80 MTNR1A (0.33) MTNR1AMTNR1BTSHR
SCHEMBL16805864 0.79 TSHR (0.38) MTNR1AMTNR1BTSHR
SCHEMBL8451742 0.78 MTNR1A (0.33) MTNR1AMTNR1BTSHR
SCHEMBL339839 0.78 TSHR (0.35) MTNR1AMTNR1BTSHRMEN1KMT2A
SCHEMBL24513273 0.75 TGFBR1 (0.37) MTNR1AMTNR1BTSHRMEN1KMT2A
SCHEMBL20901035 0.73 ALDH1A1 (0.38) MTNR1AMTNR1BTSHR
SCHEMBL11419538 0.73 FAAH (0.36) MTNR1AMTNR1BTSHR
SCHEMBL10016884 0.73 TSHR (0.32) TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0627942-B1 IMPROVEMENTS IN OR RELATING TO CONTRAST AGENTS NYCOMED IMAGING AS (NO) 1999-09-15 EP disclosed
US-5795562-A BIODEGRADABLE POLYMER AS CONTRAST AGENTS FOR DIAGNOSTIC IMAGING NYCOMED IMAGING AS (NO) 1998-08-18 US disclosed
US-5676925-A USING POLYESTER OR ACRYLATE POLYMERS NYCOMED IMAGING AS (NO) 1997-10-14 US disclosed
US-5674468-A A BIODEGRADABLE POLYESTER; USEFUL IN DIAGNOSTIC APPLICATIONS SUCH AS ULTRASOUND AND MAGNETIC RESONANCE IMAGING NYCOMED IMAGING AS (NO) 1997-10-07 US disclosed
US-5574097-A NONCROSSLINKED POLYMERS WITH BIODEGRADABLE LIPOPHILIC SIDE CHAINS INCORPORATING METHYLENE DIESTER UNITS, CLEAVABLE TO YIELD A WATER SOLUBLE POLYMER NYCOMED IMAGING AS (NO) 1996-11-12 US disclosed
EP-0629214-B1 CHEMICAL COMPOUNDS NYCOMED IMAGING AS (NO) 1996-10-23 EP disclosed
EP-0629214-A1 CHEMICAL COMPOUNDS. NYCOMED IMAGING AS (NO) 1994-12-21 EP disclosed
EP-0627942-A1 IMPROVEMENTS IN OR RELATING TO CONTRAST AGENTS NYCOMED IMAGING AS (NO) 1994-12-14 EP disclosed
WO-1993017718-A1 IMPROVEMENTS IN OR RELATING TO CONTRAST AGENTS NYCOMED IMAGING A/S (NO) 1993-09-16 WO disclosed
WO-1993018070-A1 CHEMICAL COMPOUNDS NYCOMED IMAGING AS (NO) 1993-09-16 WO disclosed