Sugi Predict

Sugi Predict / Compounds / SCHEMBL19360378

SCHEMBL19360378

SCHEMBL19360378

COC(=O)c1ccc2c(c1)cc(Cc1ccc(C(F)(F)F)cc1)n2C(C)C

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 14/20 0.64
▸ IDH1 O75874 2/20 0.46
▸ CNR2 P34972 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CNR1 P21554 1/20 0.39
▸ SRD5A2 P31213 1/20 0.38

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
SCHEMBL19360379 0.88 RORC (0.65) RORCIDH1SRD5A2
SCHEMBL19360322 0.86 RORC (0.49) RORCIDH1
SCHEMBL19360548 0.85 RORC (0.49) RORCIDH1
SCHEMBL19360388 0.84 RORC (0.55) RORCIDH1CNR2SMN1; SMN2CNR1
SCHEMBL20634743 0.82 RORC (0.46) RORCIDH1CNR2SMN1; SMN2CNR1
SCHEMBL19360580 0.82 RORC (0.63) RORC
SCHEMBL19360399 0.81 IDH1 (0.53) RORCIDH1CNR1
SCHEMBL29016632 0.80 IDH1 (0.54) RORCIDH1CNR2
SCHEMBL30370180 0.80 IDH1 (0.54) RORCIDH1CNR2
SCHEMBL19360303 0.80 RORC (0.64) 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 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