SCHEMBL28453070

SCHEMBL28453070

C1=CC(Cc2ccccc2)C=CN1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.41
POLB P06746 1/20 0.37
CALM1 P0DP23 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
SCHEMBL4357593 0.83 CALM1 (0.45) GBA1CALM1
SCHEMBL4623291 0.78 CALM1 (0.41) GBA1POLBCALM1
SCHEMBL5794073 0.76 CALM1 (0.39) GBA1POLBCALM1
SCHEMBL4361398 0.73 GBA1 (0.41) GBA1POLBCALM1
SCHEMBL6002826 0.71 CALM1 (0.39) GBA1CALM1
SCHEMBL18304984 0.66 GBA1 (0.39) GBA1POLB
SCHEMBL13889210 0.65 GBA1 (0.46) GBA1POLBCALM1
SCHEMBL13761011 0.64 TP53 (0.39) GBA1
SCHEMBL503332 0.64 RECQL (0.34)
SCHEMBL7386543 0.62 RECQL (0.33)

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-111635297-B Preparation method of internal olefin 南昌航空大学 2022-10-11 CN disclosed
CN-111635297-A Preparation method of internal olefin 南昌航空大学 2020-09-08 CN disclosed