SCHEMBL30005837

SCHEMBL30005837

O=C1CC(c2cccc(Cl)c2)c2ccccc2N1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.67
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
NPC1 O15118 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
RAB9A P51151 1/20 0.47
TP53 P04637 2/20 0.46
PKM P14618 1/20 0.46
GAA P10253 2/20 0.46
MAPT P10636 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HTR2A P28223 2/20 0.44
HTR2C P28335 2/20 0.44
HTR2B P41595 2/20 0.44
HRH3 Q9Y5N1 2/20 0.44
SLC6A3 Q01959 1/20 0.44

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
SCHEMBL880264 1.00 LMNA (0.67) LMNAKMT2AMEN1NPC1TDP1
SCHEMBL8920256 0.86 LMNA (0.54) LMNATP53GAAMAPTSLC6A3
SCHEMBL10280718 0.85 LMNA (0.63) LMNAKMT2AMEN1NPC1TDP1
SCHEMBL13522407 0.85 LMNA (0.66) LMNAKMT2AMEN1NPC1TDP1
SCHEMBL880483 0.84 LMNA (0.62) LMNAKMT2AMEN1NPC1TDP1
SCHEMBL880444 0.84 TP53 (0.59) LMNAKMT2AMEN1TP53MAPT
SCHEMBL880376 0.83 ALDH1A1 (0.58) LMNAKMT2AMEN1NPC1TDP1
SCHEMBL7156373 0.83 ALDH1A1 (0.58) LMNAKMT2AMEN1NPC1TDP1
SCHEMBL12698414 0.83 ALDH1A1 (0.58) LMNAKMT2AMEN1NPC1TDP1
SCHEMBL10280290 0.82 LMNA (0.70) LMNAKMT2AMEN1NPC1TDP1

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-113072490-B High-efficiency synthesis method of tipifarnib quinolinone intermediate 中国海洋大学 2022-08-16 CN claimed
CN-113072490-B High-efficiency synthesis method of tipifarnib quinolinone intermediate 中国海洋大学 2022-08-16 CN disclosed
CN-113072490-B High-efficiency synthesis method of tipifarnib quinolinone intermediate 中国海洋大学 2022-08-16 CN disclosed