SCHEMBL29966946

SCHEMBL29966946

CCN(CC)CCN1C(=O)[C@@](O)(c2ccccc2Cl)c2c1cc(C(N)=O)cc2C(F)(F)F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 16/20 1.00
RORC P51449 1/20 0.34
POLB P06746 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL2572828 1.00 GHSR (1.00) GHSRRORCPOLBKDM4E
SCHEMBL6376444 1.00 GHSR (1.00) GHSRRORCPOLBKDM4E
Hydrochloric Acid SCHEMBL29440072 0.99 GHSR (0.98) GHSRRORCPOLBKDM4E
Hydrochloric Acid SCHEMBL17042307 0.99 GHSR (0.98) GHSRRORCPOLBKDM4E
Hydrochloric Acid SCHEMBL17042306 0.99 GHSR (0.98) GHSRRORCPOLBKDM4E
SCHEMBL2573901 0.94 GHSR (1.00) GHSRRORC
SCHEMBL18472635 0.92 GHSR (0.86) GHSRPOLBKDM4E
SCHEMBL18488452 0.92 GHSR (0.85) GHSRPOLB
SCHEMBL6181744 0.91 GHSR (1.00) GHSRRORC
SCHEMBL6178251 0.91 GHSR (1.00) GHSRRORC

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-20220370471-A1 COMPOSITION AND METHOD FOR TREATMENT OF HIPPOCAMPAL SYNAPSE DYSFUNCTION AND COGNITIVE DEFICITS IN ALZHEIMER'S DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-11-24 US claimed
US-20220370471-A1 COMPOSITION AND METHOD FOR TREATMENT OF HIPPOCAMPAL SYNAPSE DYSFUNCTION AND COGNITIVE DEFICITS IN ALZHEIMER'S DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-11-24 US disclosed