SCHEMBL8693264

SCHEMBL8693264

O=C(CC(c1ccccc1)c1ccccc1)NN1CCN(c2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 5/20 0.46
GAA P10253 2/20 0.46
HPGD P15428 1/20 0.46
POLB P06746 2/20 0.45
LMNA P02545 3/20 0.44
NPSR1 Q6W5P4 2/20 0.44
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CCR3 P51677 1/20 0.44
KDM4E B2RXH2 1/20 0.43
GFER P55789 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
AGTR2 P50052 1/20 0.43
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL6070231 0.74 MAPT (0.54) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL6071345 0.74 EPHX2 (0.55) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL4248134 0.72 LMNA (0.64) MAPTMEN1KMT2AALDH1A1GAA
SCHEMBL6070131 0.71 KDM4E (0.47) MAPTMEN1KMT2AALDH1A1GAA
SCHEMBL8693260 0.71 ALDH1A1 (0.59) MAPTKMT2AALDH1A1GAAHPGD
SCHEMBL6071483 0.70 CCR3 (0.60) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL7402116 0.70 HTT (0.45) MAPTMEN1KMT2AALDH1A1GAA
SCHEMBL3860597 0.70 CACNA2D1 (0.61) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL7405013 0.70 ALDH1A1 (0.51) MEN1KMT2AALDH1A1HPGDLMNA
SCHEMBL20561446 0.69 KMT2A (0.55) MAPTMEN1KMT2AALDH1A1KDM4E

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-5773469-A Diaryl antimicrobial agents ORTHO PHARMACEUTICAL CORPORATION (US) 1998-06-30 US disclosed