SCHEMBL7301395

SCHEMBL7301395

Cn1c(CC2CCN(CCC(N)=O)CC2)c(C(=O)O)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 4/20 0.46
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
EGFR P00533 1/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 1/20 0.44
HTR4 Q13639 1/20 0.41

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
SCHEMBL7300755 0.88 KDM4E (0.46) HTR7ALDH1A1SMN1; SMN2HSD17B10EGFR
SCHEMBL9341470 0.86 HTR4 (0.50) HTR7ALDH1A1KDM4EHTR4
SCHEMBL7302843 0.85 KDM4E (0.44) HTR7ALDH1A1SMN1; SMN2HSD17B10EGFR
SCHEMBL7304868 0.84 SLC6A2 (0.47) HTR7KDM4EMAPT
SCHEMBL7303046 0.84 ALDH1A1 (0.46) HTR7ALDH1A1SMN1; SMN2HSD17B10EGFR
SCHEMBL9344433 0.83 CCR1 (0.46) HTR7EGFRKDM4EMAPT
SCHEMBL7309279 0.81 KDM1A (0.45) HTR7EGFRKDM4EMAPTHTR4
SCHEMBL4294891 0.81 HTR4 (0.55) HTR7KDM4EMAPTHTR4
SCHEMBL7304670 0.81 KDM1A (0.46) HTR7ALDH1A1SMN1; SMN2HSD17B10EGFR
SCHEMBL7308950 0.80 KDM1A (0.46) HTR7ALDH1A1SMN1; SMN2KDM4EMAPT

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
EP-0501322-B1 3-Piperidinylmethylcarboxylate substituted indoles GLAXO GROUP LTD (GB) 1996-09-04 EP claimed