SCHEMBL8454935

SCHEMBL8454935

O=C(OCOC(=O)c1ccc(CO)cc1)c1ccc(CO)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
HPGD P15428 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
ADRB2 P07550 1/20 0.53
ADRB1 P08588 1/20 0.53
ADRB3 P13945 1/20 0.53
PKM P14618 1/20 0.50
NPC1 O15118 1/20 0.50
NTRK1 P04629 1/20 0.44
NTRK2 Q16620 1/20 0.44
LMNA P02545 2/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
ESR1 P03372 1/20 0.44
CA7 P43166 1/20 0.44

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
SCHEMBL127525 0.83 CA1 (0.66) KMT2AMEN1HPGDSMN1; SMN2ADRB2
SCHEMBL16781804 0.83 HPGD (0.50) KMT2AMEN1HPGDSMN1; SMN2ADRB2
SCHEMBL19634298 0.83 SMN1; SMN2 (0.50) KMT2AMEN1HPGDSMN1; SMN2ADRB2
SCHEMBL6661330 0.82 F2 (0.52) KMT2AMEN1HPGDSMN1; SMN2ADRB2
SCHEMBL27541699 0.82 HPGD (0.47) KMT2AMEN1HPGDSMN1; SMN2ADRB2
SCHEMBL14787328 0.82 ESR1 (0.47) KMT2AMEN1HPGDSMN1; SMN2LMNA
SCHEMBL28525375 0.82 CA1 (0.63) KMT2AMEN1HPGDSMN1; SMN2ADRB2
SCHEMBL28527943 0.82 CA1 (0.63) KMT2AMEN1HPGDSMN1; SMN2ADRB2
SCHEMBL9115662 0.80 ALDH1A1 (0.68) KMT2AMEN1HPGDSMN1; SMN2ADRB2
SCHEMBL22767268 0.80 HPGD (0.48) KMT2AMEN1HPGDSMN1; SMN2ADRB2

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 6 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
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