SCHEMBL21390918

SCHEMBL21390918

CCC(O)(CC(=O)CCCCc1nc2ccc(C(F)(F)F)nc2n1C1CCC1)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.34
HDAC1 Q13547 4/20 0.32
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL21390990 0.90 RORC (0.32) RORC
SCHEMBL21390907 0.88 RORC (0.32) RORC
SCHEMBL21390903 0.88 RORC (0.32) RORC
SCHEMBL21390954 0.87 RORC (0.32) RORC
SCHEMBL21391012 0.87 CYP11B1 (0.32) RORC
SCHEMBL21390916 0.87 RORC (0.32) RORC
SCHEMBL21391134 0.85 RORC (0.33) RORCALDH1A1MAPTMAPK1SMN1; SMN2
SCHEMBL21391141 0.85 RORC (0.32) RORC
SCHEMBL21390848 0.84 RORC (0.33) RORCALDH1A1MAPT
SCHEMBL21390856 0.82 RORC (0.32) RORC

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
WO-2019183148-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KNOPP BIOSCIENCES LLC (US) 2019-09-26 WO disclosed