SCHEMBL7963375

SCHEMBL7963375

CCCNC(=O)[N]N1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.45
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 3/20 0.40
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 2/20 0.38
RECQL P46063 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 3/20 0.35
POLB P06746 2/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL7976882 0.86 HTT (0.55) HTTTSHRKMT2ASMN1; SMN2ALDH1A1
SCHEMBL2760109 0.73 HTT (0.77) HTTTSHRKMT2ASMN1; SMN2ALDH1A1
SCHEMBL951889 0.72 TSHR (0.46) HTTKDM4ETSHRKMT2ASMN1; SMN2
SCHEMBL8616990 0.70 SMN1; SMN2 (0.79) HTTKDM4ETSHRKMT2ASMN1; SMN2
SCHEMBL1455628 0.69 TSHR (0.56) HTTGAATSHRKMT2ASMN1; SMN2
SCHEMBL10272442 0.69 TSHR (0.61) TSHRKMT2ASMN1; SMN2ALDH1A1TDP1
SCHEMBL9194931 0.69 HTT (0.45) HTTKDM4EGAATSHRKMT2A
SCHEMBL5274851 0.69 SMN1; SMN2 (0.48) HTTGAATSHRKMT2ASMN1; SMN2
SCHEMBL11661654 0.66 MMP1 (0.46) KDM4EKMT2AALDH1A1POLB
SCHEMBL11661657 0.66 MMP1 (0.46) KDM4EKMT2AALDH1A1POLB

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-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO disclosed