SCHEMBL8635317

SCHEMBL8635317

COc1cc(N(Cc2ccc(C)o2)Cc2ccc(C)o2)cc(OC)c1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.42
PDGFRA P16234 1/20 0.42
POLB P06746 2/20 0.41
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 2/20 0.39
ACHE P22303 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
TSHR P16473 1/20 0.39
ALOX5 P09917 1/20 0.39
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37
TUBB3 Q13509 1/20 0.37
TUBB2A Q13885 1/20 0.37
TUBB8 Q3ZCM7 1/20 0.37
TUBA3E Q6PEY2 1/20 0.37

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
SCHEMBL8628489 0.85 EGFR (0.44) PDGFRBPDGFRAPOLBALDH1A1MAPK1
SCHEMBL8632136 0.80 ALDH1A1 (0.49) PDGFRBPDGFRAPOLBALDH1A1KDM4E
SCHEMBL20871931 0.76 TUBB4A (0.47) ALDH1A1MAPK1ACHEKDM4ETSHR
SCHEMBL8748534 0.73 MAPK1 (0.51) ALDH1A1MAPK1ACHEKDM4ETSHR
SCHEMBL8659550 0.72 POLB (0.50) POLBALDH1A1PKMTSHRALOX5
SCHEMBL8748519 0.71 CNR1 (0.49) ALDH1A1KDM4ETSHRLMNA
SCHEMBL8748536 0.68 ALDH1A1 (0.38) POLBALDH1A1MAPK1ACHEKDM4E
SCHEMBL9709038 0.65 TSHR (0.59) POLBALDH1A1MAPK1KDM4ETSHR
SCHEMBL13453301 0.65 POLB (0.59) POLBALDH1A1ACHEPKMTSHR
SCHEMBL82414 0.65 POLB (0.59) POLBACHEALOX5

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-5709816-A N,N-DISUBSTITUTED ANILINE COMPOUNDS KAO CORPORATION (JP) 1998-01-20 US disclosed