SCHEMBL25764630

SCHEMBL25764630

Cc1ccc(C2CC2(C)Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.39
MAOA P21397 6/20 0.39
KDM1A O60341 5/20 0.39
ACHE P22303 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
RCOR1 Q9UKL0 1/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 2/20 0.35
CYP2C9 P11712 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
MAPT P10636 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
PRCP P42785 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 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
SCHEMBL3326226 0.84 LMNA (0.46) MAOBMAOAKDM1AACHETDP1
SCHEMBL20707753 0.81 MAOB (0.45) MAOBMAOAKDM1AACHETDP1
SCHEMBL16455110 0.77 MAOB (0.65) MAOBMAOAKDM1ARCOR1ALDH1A1
SCHEMBL23964612 0.74 MAOB (0.48) MAOBMAOAKDM1AACHETDP1
SCHEMBL27865275 0.72 MAOB (0.35) MAOBMAOAKDM1AACHETDP1
SCHEMBL1758191 0.71 ALDH1A1 (0.42) MAOBMAOAKDM1AALDH1A1MEN1
SCHEMBL21103006 0.71 SLC6A2 (0.36) MAOBMAOAKDM1AALDH1A1MAPT
SCHEMBL20076806 0.71 KDM1A (0.40) MAOBKDM1ARCOR1HTR2AHTR2C
SCHEMBL21103008 0.70 MAOB (0.33) MAOBMAOAKDM1AALDH1A1LMNA
SCHEMBL18590520 0.69 ACHE (0.36) ACHEALDH1A1MEN1CYP2C9KMT2A

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
WO-2023127807-A1 ARYL CYCLOHEXANEDIONE DERIVATIVE OR SALT THEREOF, PEST CONTROL AGENT CONTAINING SAME, AND METHOD FOR USE THEREOF 株式会社ADEKA 2023-07-06 WO disclosed