SCHEMBL7586749

SCHEMBL7586749

CCCc1ccc(Cl)c(S(=O)(=O)NN2CCN(CC)C(c3ccccc3)C2)c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.44
NR1H2 P55055 14/20 0.37
NR1H3 Q13133 13/20 0.37
METAP2 P50579 1/20 0.35
LMNA P02545 1/20 0.34
SLC12A2 P55011 1/20 0.34
SLC12A5 Q9H2X9 1/20 0.34
GLA P06280 1/20 0.34

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
SCHEMBL7583716 0.83 P2RX7 (0.47) P2RX7NR1H2NR1H3LMNA
SCHEMBL7581592 0.71 P2RX7 (0.39) P2RX7NR1H2NR1H3
SCHEMBL7585196 0.71 ALDH1A1 (0.48) LMNA
SCHEMBL7585721 0.71 LMNA (0.38) LMNA
SCHEMBL7582668 0.67 HTR2C (0.37)
SCHEMBL27529415 0.67 P2RX7 (0.49) P2RX7NR1H2NR1H3LMNA
SCHEMBL18913873 0.65 P2RX7 (0.51) P2RX7NR1H2NR1H3
SCHEMBL18913827 0.65 P2RX7 (0.51) P2RX7NR1H2NR1H3
SCHEMBL27450709 0.65 P2RX7 (0.41) P2RX7NR1H2NR1H3
SCHEMBL27489861 0.63 P2RX7 (0.50) P2RX7NR1H2NR1H3LMNA

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-0675118-B1 Biphenylderivatives, process for their preparation and their use as medicaments EISAI CO LTD (JP) 2002-10-09 EP claimed