SCHEMBL8634343

SCHEMBL8634343

COC(=O)C(CCN1CCCC1)(OC(=O)c1ccccc1)C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.46
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 1/20 0.45
GLA P06280 1/20 0.45
ATM Q13315 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CYP2D6 P10635 2/20 0.45
MAPK1 P28482 1/20 0.45
GFER P55789 1/20 0.45
GAA P10253 1/20 0.44
LTA4H P09960 1/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
CHRM2 P08172 1/20 0.43
HTR1A P08908 1/20 0.43
CHRM1 P11229 1/20 0.43
OPRM1 P35372 1/20 0.43

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
SCHEMBL8629879 0.99 KMT2A (0.48) KMT2AMEN1ALDH1A1KDM4EGLA
SCHEMBL8629689 0.79 TSHR (0.50) KMT2AALDH1A1CYP2D6MAPK1LMNA
SCHEMBL27397455 0.72 MEN1 (0.50) KMT2AMEN1ALDH1A1ATMNPSR1
SCHEMBL27414232 0.72 TSHR (0.41) KMT2AALDH1A1CYP2D6MAPK1GAA
SCHEMBL8630758 0.72 IDO1 (0.44) KMT2AMEN1ALDH1A1ATMNPSR1
SCHEMBL8629579 0.71 CHRNB4 (0.37) KMT2ATSHR
SCHEMBL501862 0.70 KMT2A (0.72) KMT2AMEN1ALDH1A1ATMNPSR1
Hydrochloric Acid SCHEMBL8624619 0.69 KMT2A (0.70) KMT2AMEN1ALDH1A1KDM4ENPSR1
SCHEMBL501868 0.69 KMT2A (0.75) KMT2AMEN1ALDH1A1KDM4ENPSR1
Water SCHEMBL8479966 0.68 KMT2A (0.73) KMT2AMEN1ALDH1A1KDM4ENPSR1

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 5 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
EP-0667850-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS. DOMPE FARMACEUTICI SPA (IT) 1995-08-23 EP disclosed
WO-1994010127-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE' FARMACEUTICI S.P.A. (IT) 1994-05-11 WO disclosed