SCHEMBL7349207

SCHEMBL7349207

CC(C)(N)COC(=O)CCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.42
KDM5C P41229 2/20 0.42
PHF8 Q9UPP1 2/20 0.42
KDM2A Q9Y2K7 2/20 0.42
KDM6B O15054 1/20 0.42
LMNA P02545 3/20 0.39
ALKBH5 Q6P6C2 1/20 0.38
SUCNR1 Q9BXA5 1/20 0.38
SLC15A2 Q16348 1/20 0.36
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 2/20 0.35
MEN1 O00255 1/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 2/20 0.34
ADRA2A P08913 1/20 0.34
ADRA1A P35348 1/20 0.34
PAM P19021 2/20 0.33
GABRR1 P24046 1/20 0.33
MAPT P10636 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
SCHEMBL7349190 0.91 ADRA2A (0.39) LMNACYP1A2TSHRADRA2AADRA1A
SCHEMBL9989221 0.83 EGLN1 (0.45) EGLN1KDM5CPHF8KDM2AKDM6B
SCHEMBL8700063 0.82 EGLN1 (0.41) EGLN1KDM5CPHF8KDM2AKDM6B
SCHEMBL1104265 0.82 EGLN1 (0.41) EGLN1KDM5CPHF8KDM2AKDM6B
SCHEMBL27897028 0.81 ALDH1A1 (0.46) LMNAALDH1A1CYP1A2TSHRPAM
SCHEMBL12328700 0.80 CYP1A2 (0.38) EGLN1KDM5CPHF8KDM2AKDM6B
Hydrochloric Acid SCHEMBL11556216 0.79 ALDH1A1 (0.44) LMNAALDH1A1CYP1A2TSHRPAM
SCHEMBL26381739 0.79 EGLN1 (0.42) EGLN1KDM5CPHF8KDM2AKDM6B
SCHEMBL11912289 0.78 LMNA (0.45) EGLN1KDM5CPHF8KDM2AKDM6B
SCHEMBL1405339 0.78 LMNA (0.45) EGLN1KDM5CPHF8KDM2AKDM6B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5344957-A Amidinoiphenyl-substituted G.D. SEARLE & CO. (US) 1994-09-06 US disclosed
US-5239113-A Anticoagulants MONSANTO COMPANY (US) 1993-08-24 US disclosed