SCHEMBL7980326

SCHEMBL7980326

CCCCc1ccccc1N(C(C)=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.44
TACR1 P25103 1/20 0.41
TP53 P04637 1/20 0.41
LMNA P02545 1/20 0.40
NPY2R P49146 1/20 0.40
BID P55957 3/20 0.39
MCL1 Q07820 3/20 0.39
BCL2L1 Q07817 2/20 0.39
BAK1 Q16611 2/20 0.39
KAT8 Q9H7Z6 2/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
EP300 Q09472 1/20 0.39
KAT2A Q92830 1/20 0.39
KAT2B Q92831 1/20 0.39
KAT5 Q92993 1/20 0.39
SAE1 Q9UBE0 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
SCHEMBL7978811 0.91 PTPN1 (0.46) PTPN1TACR1TP53LMNAMEN1
SCHEMBL7985518 0.85 LMNA (0.51) PTPN1TP53LMNAMEN1TSHR
SCHEMBL9231093 0.80 BID (0.42) TACR1TP53BIDMCL1BCL2L1
SCHEMBL1954009 0.80 NPY2R (0.42) PTPN1NPY2RBIDMCL1BCL2L1
SCHEMBL31518126 0.80 AKR1B1 (0.47) PTPN1LMNAMEN1TSHRKMT2A
SCHEMBL5809365 0.79 CYP3A4 (0.42) TP53NPY2RBIDMCL1BCL2L1
SCHEMBL27463138 0.78 PTPN1 (0.59) PTPN1LMNANPY2RMEN1TSHR
SCHEMBL10759132 0.77 TSHR (0.48) MEN1TSHRKMT2APPARA
SCHEMBL3218535 0.76 NPY2R (0.44) NPY2RBIDMCL1BCL2L1BAK1
SCHEMBL28211185 0.76 CYP3A4 (0.41) TP53NPY2RCYP3A4CYP2D6CYP2C9

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
US-6235730-B1 ANTICHOLESTEROL AGENT, ANTILIPEMIC AGENT JAPAN TOBACCO, INC. (JP) 2001-05-22 US disclosed
EP-0970954-A1 3-PIPERIDYL-4-OXOQUINAZOLINE DERIVATIVES AND MEDICINCAL COMPOSITIONS CONTAINING THE SAME JAPAN TOBACCO INC. (JP) 2000-01-12 EP disclosed