SCHEMBL9470666

SCHEMBL9470666

Cn1cc(CC(=O)Cl)c2cc(Br)ccc21

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.43
CNR1 P21554 2/20 0.43
LMNA P02545 4/20 0.42
MAPT P10636 4/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 3/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 1/20 0.40
S1PR2 O95136 1/20 0.40
PTPN5 P54829 1/20 0.40
NQO2 P16083 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
SPR P35270 1/20 0.39

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
SCHEMBL4668108 0.87 TBXAS1 (0.44) CNR2CNR1LMNAMAPTALDH1A1
SCHEMBL15759095 0.84 LMNA (0.46) CNR2CNR1LMNAMAPTALDH1A1
SCHEMBL20604920 0.83 KDM4E (0.47) CNR2CNR1LMNAMAPTKDM4E
SCHEMBL23175314 0.78 GPR84 (0.61) LMNAMAPTALDH1A1KDM4EMEN1
SCHEMBL29623198 0.78 GPR84 (0.61) LMNAMAPTALDH1A1KDM4EMEN1
SCHEMBL18509694 0.78 LMNA (0.49) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL28566679 0.76 ADRB2 (0.41) LMNAMAPTKDM4ENQO2MTNR1A
SCHEMBL18029130 0.75 MAPT (0.48) LMNAMAPTALDH1A1KDM4EMEN1
SCHEMBL7385651 0.75 KMT2A (0.41) LMNAMAPTALDH1A1MEN1KMT2A
SCHEMBL2381934 0.74 HTR6 (0.47) LMNAMAPTALDH1A1KDM4E

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
US-5192770-A Antiemetic, anxiolytic, cognition activator SYNTEX (U.S.A.) INC. (US) 1993-03-09 US disclosed