SCHEMBL9683909

SCHEMBL9683909

CCN1CC(Oc2c(C)cccc2C)C1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.40
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 1/20 0.39
HTR1A P08908 3/20 0.37
SLC6A2 P23975 3/20 0.37
FPR2 P25090 1/20 0.36
PROKR1 Q8TCW9 1/20 0.36
KIF11 P52732 1/20 0.36
KDM4E B2RXH2 2/20 0.36

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
Hydrochloric Acid SCHEMBL9682487 0.98 SLC6A4 (0.39) SLC6A4ALDH1A1KMT2AHTR1ASLC6A2
SCHEMBL22857078 0.81 SLC6A4 (0.42) SLC6A4ALDH1A1KMT2ASLC6A2
SCHEMBL9683102 0.76 ALDH1A1 (0.44) SLC6A4ALDH1A1KMT2AKDM4E
Hydrochloric Acid SCHEMBL9683107 0.75 ALDH1A1 (0.43) SLC6A4ALDH1A1KMT2AHTR1AKDM4E
SCHEMBL20158436 0.75 SLC6A4 (0.55) SLC6A4ALDH1A1SLC6A2KDM4E
SCHEMBL20012540 0.74 CARM1 (0.47) SLC6A4ALDH1A1SLC6A2KDM4E
SCHEMBL20176813 0.72 SLC6A4 (0.38) SLC6A4HTR1ASLC6A2KDM4E
SCHEMBL9683890 0.72 ALDH1A1 (0.43) SLC6A4ALDH1A1KMT2AHTR1ASLC6A2
SCHEMBL20176569 0.72 SLC6A4 (0.36) SLC6A4
SCHEMBL20165883 0.70 SLC6A4 (0.39) SLC6A4

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-5130309-A Cardiovascular disorders A. H. ROBINS COMPANY, INCORPORATED (US) 1992-07-14 US claimed