SCHEMBL8829296

SCHEMBL8829296

CC(N)C(=O)NC(C)C(=O)NCC1=CC(c2ccccc2)Cc2c1ccc(OC(=O)c1ccccc1)c2OC(=O)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 10/20 0.35
MASP2 O00187 9/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33

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
SCHEMBL8829302 1.00 F2 (0.35) F2MASP2CARM1PRMT6
SCHEMBL7449625 0.90 MASP2 (0.34) F2MASP2CARM1PRMT6
SCHEMBL7449628 0.90 MASP2 (0.34) F2MASP2CARM1PRMT6
Hydrochloric Acid SCHEMBL8829325 0.89 MASP2 (0.33) F2MASP2CARM1PRMT6
Hydrochloric Acid SCHEMBL8829320 0.89 MASP2 (0.33) F2MASP2CARM1PRMT6
SCHEMBL7444849 0.84 CARM1 (0.36) CARM1PRMT6
SCHEMBL7444847 0.84 CARM1 (0.36) CARM1PRMT6
SCHEMBL7447039 0.79 KMT2A (0.36)
SCHEMBL7447921 0.79 KMT2A (0.38)
SCHEMBL7447927 0.79 KMT2A (0.38)

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-0474767-B1 DOPAMINE AGONISTS ABBOTT LAB (US) 1996-02-21 EP claimed
EP-0474767-A4 DOPAMINE AGONISTS 1992-07-08 EP claimed
EP-0474767-A1 DOPAMINE AGONISTS. ABBOTT LAB (US) 1992-03-18 EP claimed
WO-1990015056-A1 DOPAMINE AGONISTS ABBOTT LABORATORIES (US) 1990-12-13 WO claimed
US-5621133-A PREPARING A 1-(3,4-DIALKOXYPHENYL),3-HYDROXYALKANE(C6-C12) BY EPOXIDIZING A HALO DERIVATIVE WITH A BASE FOLLOWED BY DECYCLICIZING WITH AN ORGANOMETALLIC COMPOUND IN A SOLVENT; NAPHTHYLENES, ISOCHROMENES AND ISOTHIOCHROMENES DENINNO MICHAEL P (US) 1997-04-15 US disclosed
US-5591884-A PROTECTED HYDROXYALKYLCATECHOL INTERMEDIATES ABBOTT LABORATORIES (US) 1997-01-07 US disclosed
EP-0474767-B1 DOPAMINE AGONISTS ABBOTT LAB (US) 1996-02-21 EP disclosed
EP-0474767-A4 DOPAMINE AGONISTS 1992-07-08 EP disclosed
EP-0474767-A1 DOPAMINE AGONISTS. ABBOTT LAB (US) 1992-03-18 EP disclosed
WO-1990015056-A1 DOPAMINE AGONISTS ABBOTT LABORATORIES (US) 1990-12-13 WO disclosed