SCHEMBL7059986

SCHEMBL7059986

Cc1c(OC(C)N(C)C)c2cc(Br)ccc2n1C(=O)c1ccccc1Br

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.39
ELANE P08246 3/20 0.36
TSPO P30536 1/20 0.34
CNR1 P21554 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL6823561 0.80 MEN1 (0.42) CNR2ELANEALDH1A1LMNAPOLB
SCHEMBL6820214 0.71 MEN1 (0.41) CNR2CNR1ALDH1A1
SCHEMBL6823922 0.70 CNR1 (0.47) CNR2CNR1LMNA
SCHEMBL20158839 0.69 ELANE (0.42) CNR2ELANEALDH1A1
SCHEMBL6821066 0.69 HTR7 (0.42) CNR2CNR1ALDH1A1LMNAPOLB
SCHEMBL6821172 0.67 ELANE (0.45) ELANEALDH1A1LMNA
SCHEMBL24200422 0.67 MAPK8 (0.51) CNR2ELANEALDH1A1POLB
SCHEMBL6820274 0.66 HTR7 (0.39) ALDH1A1LMNA
SCHEMBL6824409 0.65 KDM4E (0.40) ALDH1A1LMNA
SCHEMBL20159049 0.65 EGFR (0.36) CNR2ELANEALDH1A1LMNAHTT

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-2004048331-A1 N-ARYLALKYL-3-AMINOALKOXYINDOLES AND THEIR USE AS 5-HT LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2004-06-10 WO claimed