SCHEMBL8447280

SCHEMBL8447280

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

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 6/20 0.33
MTNR1B P49286 6/20 0.33
TSHR P16473 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
GALR3 O60755 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TRPV1 Q8NER1 1/20 0.31
TGFBR1 P36897 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
SCHEMBL8451742 0.83 MTNR1A (0.33) MTNR1AMTNR1BTSHRMAPTTGFBR1
SCHEMBL9399525 0.81 TSHR (0.34) MTNR1AMTNR1BTSHRCHRM2CHRM4
SCHEMBL8448332 0.80 MTNR1A (0.32) MTNR1AMTNR1BTSHR
SCHEMBL16805864 0.80 TSHR (0.38) MTNR1AMTNR1BTSHRCHRM2CHRM4
SCHEMBL8447931 0.78 MTNR1A (0.33) MTNR1AMTNR1BTSHRMAPTTGFBR1
SCHEMBL24513273 0.76 TGFBR1 (0.37) MTNR1AMTNR1BTSHRMAPTTGFBR1
SCHEMBL339839 0.76 TSHR (0.35) MTNR1AMTNR1BTSHRMAPTTGFBR1
SCHEMBL20901035 0.74 ALDH1A1 (0.38) MTNR1AMTNR1BTSHRMAPTTGFBR1
SCHEMBL11419538 0.74 FAAH (0.36) MTNR1AMTNR1BTSHRMAPTTGFBR1
SCHEMBL11435770 0.73 MTNR1A (0.33) MTNR1AMTNR1BTSHRMAPTTGFBR1

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 8 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
WO-1993018070-A1 CHEMICAL COMPOUNDS NYCOMED IMAGING AS (NO) 1993-09-16 WO disclosed