SCHEMBL8634964

SCHEMBL8634964

CCOC(=O)C(CCc1ccncc1)(OC(=O)c1ccccc1)C(=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 5/20 0.46
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 1/20 0.41
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
GAA P10253 1/20 0.40
ALDH1A1 P00352 3/20 0.40
CDC7 O00311 1/20 0.40
DBF4 Q9UBU7 1/20 0.40
MAPT P10636 1/20 0.40
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 1/20 0.39
NLRP1 Q9C000 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TSHR P16473 1/20 0.38
PIN1 Q13526 1/20 0.38

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
SCHEMBL8633560 0.87 KMT2A (0.47) NAMPTL3MBTL1LMNAKMT2AGAA
SCHEMBL8629786 0.82 KDM4E (0.45) L3MBTL1LMNAKMT2AKDM4EGAA
SCHEMBL8631399 0.80 LMNA (0.45) LMNAKMT2AGAAALDH1A1MAPT
SCHEMBL8636980 0.75 LMNA (0.43) LMNAKMT2AGAAALDH1A1MAPT
SCHEMBL8783322 0.74 NAMPT (0.45) NAMPTL3MBTL1LMNAKMT2AGAA
SCHEMBL27597150 0.74 ESR1 (0.64) L3MBTL1LMNAKMT2AKDM4EALDH1A1
SCHEMBL8634552 0.74 ALDH1A1 (0.46) LMNAKDM4EGAAALDH1A1MAPT
SCHEMBL8633545 0.71 SLC7A5 (0.43) LMNAKMT2AGAAALDH1A1POLB
Ethyl Benzoate SCHEMBL27597151 0.71 L3MBTL1 (0.58) L3MBTL1LMNAKMT2AGAAALDH1A1
SCHEMBL8633540 0.71 IDO1 (0.46) LMNAKMT2AKDM4EGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5773465-A Tartronic acids, their acetalic ethers and o-esters DOMPE FARMACEUTICI S.P.A. (IT) 1998-06-30 US disclosed
US-5656656-A Tartronic acids, their acetalic ethers and O-esters DOMPE FARMACEUTICI S.P.A. (IT) 1997-08-12 US disclosed
EP-0667850-B1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE FARMACEUTICI SPA (IT) 1997-05-28 EP disclosed
WO-1994010127-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE' FARMACEUTICI S.P.A. (IT) 1994-05-11 WO disclosed