SCHEMBL11298671

SCHEMBL11298671

CS(=O)(=O)CC(=O)c1[nH]c2ccc(Cl)cc2c1-c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2 P11137 7/20 0.67
ALDH1A1 P00352 5/20 0.63
KDM4E B2RXH2 3/20 0.63
HPGD P15428 2/20 0.63
CYP1A2 P05177 1/20 0.63
XBP1 P17861 1/20 0.63
CYP2C19 P33261 1/20 0.63
MAPT P10636 3/20 0.60
POLB P06746 1/20 0.60
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
ATM Q13315 2/20 0.56
PTGS2 P35354 1/20 0.55
CSF1R P07333 2/20 0.54
ROCK2 O75116 1/20 0.52
MAP4K4 O95819 1/20 0.52
LCK P06239 1/20 0.52
PIM1 P11309 1/20 0.52
RPS6KB1 P23443 1/20 0.52
CDK2 P24941 1/20 0.52

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
SCHEMBL11300082 0.93 MAP2 (0.62) MAP2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11557335 0.91 MAP2 (0.54) MAP2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11305292 0.88 MAP2 (0.54) MAP2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11307889 0.87 MAP2 (0.52) MAP2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11555777 0.86 MAP2 (0.48) MAP2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11343474 0.85 ALDH1A1 (0.61) MAP2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11255054 0.84 MAP2 (0.47) MAP2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11298462 0.84 MAP2 (0.52) MAP2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11305349 0.84 MAP2 (0.46) MAP2ALDH1A1KDM4EHPGDCYP1A2
SCHEMBL11297232 0.83 MAP2 (0.47) MAP2ALDH1A1KDM4EHPGDCYP1A2

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
US-4255442-A 2-[(Methylsulfinyl)]-3-phenylindoles SCHERING CORPORATION (US) 1981-03-10 US disclosed
EP-0000972-A2 2-Substituted-3-phenylindoles, their preparation, and pharmaceutical compositions containing them Technobiotic Ltd. (CH) 1979-03-07 EP disclosed