SCHEMBL9400348

SCHEMBL9400348

C/C(C=CC1(F)CC1c1ccc(Cl)c(Cl)c1)=C\C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.38
RXRA P19793 2/20 0.35
RARB P10826 1/20 0.35
RARG P13631 1/20 0.35
SLC6A4 P31645 12/20 0.33
SLC6A2 P23975 11/20 0.33
SLC6A3 Q01959 9/20 0.33
BACE1 P56817 1/20 0.31

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
SCHEMBL8967736 1.00 NPSR1 (0.38) NPSR1RXRARARBRARGSLC6A4
SCHEMBL8967697 0.89 RXRA (0.44) RXRARARBRARGSLC6A4SLC6A2
SCHEMBL9515730 0.83 MEN1 (0.34) RXRARARBRARGSLC6A4SLC6A2
SCHEMBL27399659 0.82 NPSR1 (0.40) NPSR1SLC6A4SLC6A2SLC6A3BACE1
SCHEMBL9455450 0.82 MMP1 (0.38) RXRARARBRARGSLC6A4SLC6A2
SCHEMBL27364424 0.82 MMP1 (0.38) RXRARARBRARGSLC6A4SLC6A2
SCHEMBL9515299 0.81 HPGD (0.40) RXRARARBRARGSLC6A4SLC6A2
SCHEMBL9455335 0.80 MMP1 (0.36)
SCHEMBL27359328 0.79 F11 (0.32) SLC6A4SLC6A2SLC6A3
SCHEMBL8967734 0.77 MAOB (0.32) SLC6A4SLC6A2SLC6A3

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-5326755-A Contain cyclopropane ring ROUSSEL UCLAF 1994-07-05 US disclosed