SCHEMBL8488018

SCHEMBL8488018

CCC(ONCc1ccc(OC)cc1)C(=O)N1CCN(Cc2cccnc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.52
KDM4E B2RXH2 5/20 0.51
LMNA P02545 1/20 0.51
ALDH1A1 P00352 4/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
PKM P14618 1/20 0.49
RAB9A P51151 1/20 0.49
GFER P55789 1/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LSS P48449 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL8485433 0.81 KDM4E (0.60) POLBKDM4ELMNAALDH1A1MEN1
SCHEMBL7374466 0.80 KDM4E (0.52) POLBKDM4ELMNAALDH1A1MEN1
SCHEMBL8487156 0.73 POLB (0.44) POLBKDM4ELMNAALDH1A1MEN1
SCHEMBL8541313 0.72 CYP3A4 (0.46) KDM4ELMNAALDH1A1MEN1KMT2A
SCHEMBL7372501 0.72 KDM4E (0.54) POLBKDM4ELMNAALDH1A1MEN1
SCHEMBL8029944 0.70 SIGMAR1 (0.53) POLBKDM4ELMNAALDH1A1MEN1
SCHEMBL16130555 0.70 KDM4E (0.70) KDM4ELMNAALDH1A1KMT2AMAPT
SCHEMBL8144593 0.69 KDM4E (0.66) POLBKDM4ELMNAALDH1A1MEN1
SCHEMBL27781452 0.69 KDM4E (0.69) KDM4ELMNAALDH1A1HTT
SCHEMBL8029589 0.69 TSHR (0.61) KDM4ELMNAALDH1A1MEN1KMT2A

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-5929074-A VSODILATOR, ANTIALLERGIC AND ANTIPLATELET AGENTS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1999-07-27 US disclosed
US-5728702-A BRONCHODILATOR AGENTS, ANTIALLERGENS OR ANTIPLATELET DRUGGS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-17 US disclosed