SCHEMBL9519739

SCHEMBL9519739

O=c1sc(CO)c(C(F)(F)F)n1CC1CC1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.32
CNR1 P21554 6/20 0.32
RORA P35398 1/20 0.31
RORC P51449 1/20 0.31
RORB Q92753 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
SCHEMBL10391799 0.78 CNR2 (0.33) CNR2CNR1
SCHEMBL10391800 0.78 CNR2 (0.38) CNR2CNR1
SCHEMBL9519978 0.78 NOTUM (0.36) CNR2CNR1
SCHEMBL9868262 0.74 CNR2 (0.48) CNR2CNR1
SCHEMBL9865916 0.73
SCHEMBL9866855 0.72 ALDH1A1 (0.30)
SCHEMBL9521058 0.71 KDM4E (0.47)
SCHEMBL9521039 0.64 GRM2 (0.34) CNR2CNR1RORARORCRORB
SCHEMBL23153535 0.55 GRM2 (0.42) CNR2
SCHEMBL9521296 0.52 TKT (0.35) CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300898-B1 PYRETHRINOID DERIVATIVES CONTAINING AN N-HETEROCYCLE, PROCESSES AND INTERMEDIATES FOR THEIR PREPARATION, THEIR USE AS PESTICIDES AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1993-03-10 EP disclosed
US-5008281-A Insecticides, miticides, nematocides ROUSSEL UCLAF (FR) 1991-04-16 US disclosed
US-4925862-A PESTICIDES ROUSSEL UCLAF (FR) 1990-05-15 US disclosed