SCHEMBL19360322

SCHEMBL19360322

COC(=O)c1ccc2c(c1)cc(Cc1ccc(C(F)(F)F)cc1F)n2C(C)C

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RORC P51449 12/20 0.49
KIF11 P52732 2/20 0.37
IDH1 O75874 1/20 0.37
TLR2 O60603 1/20 0.36
TLR1 Q15399 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
IDO1 P14902 1/20 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
SCHEMBL19360548 0.89 RORC (0.49) RORCKIF11IDH1TLR2TLR1
SCHEMBL19360326 0.89 RORC (0.49) RORC
SCHEMBL19360378 0.86 RORC (0.64) RORCIDH1
SCHEMBL19360593 0.85 KDM4E (0.43) RORCKIF11IDH1TLR2TLR1
SCHEMBL19360303 0.84 RORC (0.64) RORCKIF11
SCHEMBL19360580 0.83 RORC (0.63) RORCKIF11
SCHEMBL19360539 0.83 RORC (0.46) RORCIDH1TLR2TLR1
SCHEMBL19360575 0.82 RORC (0.65) RORCKIF11
SCHEMBL19360320 0.79 RORC (0.82) RORC
SCHEMBL19360367 0.78 RORC (0.66) RORCKIF11IDH1

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
CN-107531679-B Aromatic amide derivative, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2021-07-02 CN disclosed
WO-2017157332-A1 AROMATIC AMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL APPLICATIONS THEREOF 江苏恒瑞医药股份有限公司 2017-09-21 WO disclosed