SCHEMBL28538547

SCHEMBL28538547

CC(C)c1[nH]c(C(C)(C)C(F)(F)F)cc1N

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.33

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
SCHEMBL28532595 0.71 PDE2A (0.33) PDE2A
SCHEMBL19868200 0.65
SCHEMBL21590039 0.54 ALDH1A1 (0.41)
SCHEMBL16055562 0.53 IKBKB (0.31)
SCHEMBL24127040 0.53 ALDH1A1 (0.40)
SCHEMBL10189311 0.52 PDE2A (0.70) PDE2A
SCHEMBL24118137 0.52 PTPN5 (0.42) PDE2A
SCHEMBL24117855 0.52 KDM4E (0.33)
SCHEMBL21737375 0.51 EIF4A3 (0.31)
SCHEMBL1147216 0.51 PDE2A (0.57) PDE2A

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
CN-114621233-A Substituted aromatic condensed ring derivative and its composition and use 深圳市塔吉瑞生物医药有限公司 2022-06-14 CN disclosed
CN-112552302-B Substituted aromatic fused ring derivatives, compositions and uses thereof 深圳市塔吉瑞生物医药有限公司 2022-05-13 CN disclosed
CN-112552302-A Substituted aromatic fused ring derivatives, compositions and uses thereof 深圳市塔吉瑞生物医药有限公司 2021-03-26 CN disclosed