SCHEMBL11541925

SCHEMBL11541925

O=C(c1ccc(Nc2ccnc3cc(Cl)ccc23)cc1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 2/20 0.58
MAPT P10636 3/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
MAPK1 P28482 1/20 0.56
STAT3 P40763 1/20 0.56
GAA P10253 3/20 0.52
ATM Q13315 1/20 0.52
LMNA P02545 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 3/20 0.50
HTT P42858 3/20 0.50
NPSR1 Q6W5P4 1/20 0.50
PKM P14618 1/20 0.49
RAD52 P43351 1/20 0.49
GFER P55789 1/20 0.49
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48

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
SCHEMBL11543575 0.95 MAPKAPK2 (0.53) MAPKAPK2MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL10670035 0.95 MAPKAPK2 (0.53) MAPKAPK2MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL11544358 0.95 MAPKAPK2 (0.53) MAPKAPK2MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL11540780 0.95 ALDH1A1 (0.57) MAPKAPK2MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL11542427 0.92 MAPT (0.51) MAPKAPK2MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL11544220 0.91 KMT2A (0.53) MAPKAPK2MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL7352945 0.91 MAPKAPK2 (0.53) MAPKAPK2MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL11507879 0.90 MAPT (0.59) MAPTKMT2ASMN1; SMN2GAAATM
SCHEMBL11545265 0.89 MAPKAPK2 (0.51) MAPKAPK2MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL11541437 0.87 GAA (0.49) MAPKAPK2MAPTMEN1KMT2ASMN1; SMN2

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
US-4167567-A Antihypertensive 4-aminoquinolines THE UPJOHN COMPANY (US) 1979-09-11 US disclosed