SCHEMBL8938800

SCHEMBL8938800

COc1ccccc1Nc1cc(Oc2ccc(Cl)cc2Cl)ccc1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNLIP P16233 2/20 0.44
MAPT P10636 5/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
RECQL P46063 1/20 0.44
DUSP3 P51452 1/20 0.44
PTPN5 P54829 1/20 0.44
PTPN11 Q06124 1/20 0.44
NPC1 O15118 2/20 0.43
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43
TSHR P16473 1/20 0.43
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP3A4 P08684 1/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
ALDH1A1 P00352 3/20 0.41

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
SCHEMBL8938808 0.85 MAPT (0.47) MAPTLMNAHTTRECQLDUSP3
SCHEMBL8938811 0.81 TDP1 (0.59) MAPTLMNARECQLDUSP3PTPN5
SCHEMBL9807493 0.79 ALDH1A1 (0.54) MAPTLMNAHTTTSHRCYP1A2
SCHEMBL9119816 0.76 KMT2A (0.54) MAPTLMNAHTTRECQLDUSP3
SCHEMBL13609065 0.76 SRC (0.55) MAPTLMNAHTTRECQLDUSP3
SCHEMBL9120543 0.75 MAPT (0.55) MAPTLMNAHTTRECQLDUSP3
SCHEMBL8938797 0.74 CYP1A2 (0.41) MAPTLMNAHTTRECQLDUSP3
SCHEMBL11011793 0.73 MAPT (0.56) MAPTLMNAHTTTSHRCYP1A2
SCHEMBL9332143 0.72 MAPT (0.51) MAPTLMNAHTTTSHRCYP1A2
SCHEMBL1922107 0.71 MAPT (0.62) MAPTLMNAHTTRECQLDUSP3

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-5484762-A Aryloxy-n-(substituted phenyl) benzotriazole herbicidal agents AMERICAN CYANAMID COMPANY (US) 1996-01-16 US disclosed