SCHEMBL31318334

SCHEMBL31318334

O=CN1CCC(c2cc3ccccc3nc2Cl)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 5/20 0.37
HPGD P15428 3/20 0.37
GAA P10253 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
GSK3B P49841 1/20 0.37
CNR2 P34972 2/20 0.36
KDM4E B2RXH2 3/20 0.36
CNR1 P21554 1/20 0.35
FAAH O00519 1/20 0.35
TDP1 Q9NUW8 3/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL10976734 0.83 PKM (0.49) LMNAPKMRAB9ASMN1; SMN2KMT2A
SCHEMBL31318337 0.78 TDP1 (0.41) LMNAPKMRAB9ACNR2KDM4E
SCHEMBL13801368 0.69 BRD4 (0.43) ALDH1A1
SCHEMBL21649751 0.69 HTR2B (0.57) PKMKMT2A
SCHEMBL8145710 0.69 DRD2 (0.40) LMNAKMT2ACYP3A4CNR2CNR1
SCHEMBL17224419 0.67 RBP4 (0.43)
SCHEMBL17224436 0.67 SCD5 (0.49) L3MBTL1
SCHEMBL23368535 0.66 RBP4 (0.38) KMT2AGAA
SCHEMBL13450162 0.66 HTR2C (0.53) FAAH
SCHEMBL6203314 0.66 TSHR (0.45) LMNARAB9ASMN1; SMN2KMT2AALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119306698-A Novel method for preparing zavigpam intermediate 浙江工业大学 2025-01-14 CN disclosed