SCHEMBL8484271

SCHEMBL8484271

CCOC(=O)CCCN1CCC(C(=O)O)CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 1/20 0.44
LMNA P02545 2/20 0.44
KCNH2 Q12809 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
HRH3 Q9Y5N1 2/20 0.43
CYP1A2 P05177 1/20 0.42
LTA4H P09960 1/20 0.42
EGFR P00533 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL7010720 0.91 SMN1; SMN2 (0.53) LMNASMN1; SMN2LTA4HEGFRL3MBTL1
SCHEMBL11454925 0.89 LMNA (0.54) LMNAKCNH2SMN1; SMN2HRH3LTA4H
SCHEMBL17285917 0.84 KMT2A (0.49) HTR4KCNH2HRH3CYP1A2RAB9A
SCHEMBL27887743 0.84 HTR4 (0.48) HTR4LMNAKCNH2HRH3CYP1A2
SCHEMBL11861074 0.84 CYP1A2 (0.53) HTR4LMNASMN1; SMN2CYP1A2RAB9A
SCHEMBL27871503 0.83 HTR4 (0.45) HTR4LMNAKCNH2HRH3CYP1A2
SCHEMBL17284641 0.83 SMYD3 (0.54) HTR4LMNAKCNH2SMN1; SMN2HRH3
SCHEMBL22878317 0.83 HTR4 (0.47) HTR4LMNAKCNH2SMN1; SMN2HRH3
SCHEMBL9058323 0.82 HTR4 (0.45) HTR4CYP1A2RAB9AL3MBTL1
SCHEMBL7372305 0.81 ALDH1A1 (0.48) SMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5922717-A ANTICOAGULANTS DR. KARL THOMAE GMBH (DE) 1999-07-13 US disclosed