SCHEMBL11113040

SCHEMBL11113040

C#CCOc1ccccc1N1CCCC1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.40
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAOB P27338 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2A6 P11509 1/20 0.38
APOBEC3A P31941 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
HTR1A P08908 1/20 0.37
GAA P10253 1/20 0.36
TP53 P04637 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL11114830 0.86 KMT2A (0.41) MAPTKDM4EMEN1KMT2AAPOBEC3A
SCHEMBL11109892 0.84 KDM4E (0.40) MAPTKDM4EMEN1KMT2AAPOBEC3A
SCHEMBL10274496 0.79 SMN1; SMN2 (0.48) DRD2MAPTKDM4EMEN1KMT2A
SCHEMBL11113990 0.78 OPRM1 (0.47) MAPTKDM4EMEN1KMT2ACYP3A4
SCHEMBL11112128 0.78 ADRA2A (0.43) MAPTKDM4EMEN1KMT2ACYP3A4
SCHEMBL1829260 0.76 MAPT (0.58) DRD2MAPTKDM4EMEN1KMT2A
SCHEMBL11117956 0.76 KDM4E (0.40) MAPTKDM4EADRA1DADRA1AADRA1B
SCHEMBL27482179 0.74 KDM4E (0.42) MAPTKDM4EMEN1KMT2ACYP3A4
SCHEMBL11114854 0.73 MAPT (0.42) MAPTKDM4ECYP3A4APOBEC3AAPOBEC3G
SCHEMBL19327260 0.72 ADRA1A (0.49) ADRA1DADRA1AADRA1B

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
EP-0106988-A1 Pharmacologically active lactam derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1984-05-02 EP claimed
EP-0106988-A1 Pharmacologically active lactam derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1984-05-02 EP disclosed