SCHEMBL28065059

SCHEMBL28065059

CC(C)OC(=O)c1cnccc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 2/20 0.45
ALDH1A1 P00352 3/20 0.41
RBP4 P02753 1/20 0.41
CA12 O43570 4/20 0.40
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
CA7 P43166 4/20 0.40
CA9 Q16790 4/20 0.40
CA14 Q9ULX7 4/20 0.40
NTRK1 P04629 1/20 0.39
CFTR P13569 1/20 0.39
PDK2 Q15119 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
DGAT2 Q96PD7 1/20 0.37
DHODH Q02127 1/20 0.37
THRB P10828 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GLA P06280 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
SCHEMBL3093031 0.83 ALDH1A1 (0.54) NPC1POLBMAPTALDH1A1RBP4
SCHEMBL18706161 0.81 NPC1 (0.46) NPC1POLBMAPTALDH1A1RBP4
SCHEMBL679589 0.80 NPC1 (0.52) NPC1POLBMAPTALDH1A1RBP4
SCHEMBL16455673 0.80 POLB (0.47) NPC1POLBMAPTALDH1A1RBP4
SCHEMBL3642887 0.80 NPC1 (0.52) NPC1POLBMAPTALDH1A1RBP4
SCHEMBL13797528 0.80 NPC1 (0.49) NPC1POLBMAPTALDH1A1RBP4
SCHEMBL29638304 0.79 MAPT (0.48) NPC1POLBMAPTALDH1A1L3MBTL1
SCHEMBL28109640 0.79 MAPT (0.48) NPC1POLBMAPTALDH1A1L3MBTL1
SCHEMBL4394775 0.79 NPC1 (0.56) NPC1POLBMAPTALDH1A1RBP4
SCHEMBL800329 0.78 LMNA (0.54) NPC1ALDH1A1CA12CA1CA2

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-119859107-A Flonicamid intermediate preparation of body and application thereof 帕潘纳(北京)科技有限公司 2025-04-22 CN disclosed
CN-105451558-A Pyrazolyl pyrrolinones and their use as herbicides SYNGENTA PARTICIPATIONS AG 2016-03-30 CN disclosed