SCHEMBL26656347

SCHEMBL26656347

C[C@H]1CN(CC=O)c2ccc(F)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
PER2 O15055 7/20 0.35
CRY2 Q49AN0 3/20 0.35
MAPK1 P28482 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
GRIA2 P42262 2/20 0.33
CACNA1G O43497 1/20 0.33
CACNA1H O95180 1/20 0.33
CACNA1I Q9P0X4 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
NR1I2 O75469 1/20 0.33
RORC P51449 1/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 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
SCHEMBL12363786 0.73 POLB (0.41) POLBCA1CA2HTR2AHTR2C
SCHEMBL18373772 0.71 POLB (0.40) POLBCA1CA2HTR2AHTR2C
SCHEMBL13068270 0.71 HTT (0.40) POLBCA1CA2HTR2AHTR2C
SCHEMBL26817417 0.70 NOTUM (0.62) POLBCA1CA2MAPK1NPC1
SCHEMBL14608536 0.69 NOTUM (0.45) POLBCA1CA2MAPK1NPC1
SCHEMBL13267691 0.68 MAPK1 (0.42) MAPK1GRIA2NPC1ALDH1A1HTT
SCHEMBL8264212 0.65 L3MBTL1 (0.35) MAPK1ALDH1A1
SCHEMBL25290240 0.65 POLB (0.41) POLBCA1CA2MAPK1GRIA2
SCHEMBL13077984 0.65 HSD11B1 (0.39) ALDH1A1
SCHEMBL6684665 0.63 PRCP (0.45) ALDH1A1

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
EP-4526289-A1 ANTIVIRAL INDOLINYL COMPOUNDS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2025-03-26 EP disclosed
WO-2023225162-A1 ANTIVIRAL INDOLINYL COMPOUNDS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2023-11-23 WO disclosed