SCHEMBL7609633

SCHEMBL7609633

CCCCCCC(C)CNC1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
SIGMAR1 Q99720 2/20 0.41
EPHX1 P07099 9/20 0.41
EPHX2 P34913 2/20 0.41
GNAI3 P08754 2/20 0.38
GNAO1 P09471 2/20 0.38
GNAI1 P63096 2/20 0.38
ANPEP P15144 2/20 0.37
ERAP2 Q6P179 2/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL11053758 0.98 KDM4E (0.46) KDM4ESIGMAR1EPHX1EPHX2ANPEP
SCHEMBL11058163 0.93 KDM4E (0.47) KDM4ESIGMAR1EPHX1EPHX2ANPEP
SCHEMBL11054718 0.85 KDM4E (0.50) KDM4EEPHX1ANPEPERAP2HTT
SCHEMBL22236675 0.84 KDM4E (0.46) KDM4ESIGMAR1EPHX1EPHX2GNAI3
SCHEMBL18814445 0.83 METAP1 (0.46) KDM4EGNAI3GNAO1GNAI1
SCHEMBL20016428 0.81 GNAI3 (0.33) EPHX1GNAI3GNAO1GNAI1
SCHEMBL25708221 0.81 ALDH1A1 (0.44) KDM4ESIGMAR1EPHX1EPHX2GNAI3
SCHEMBL22115045 0.81 S1PR1 (0.34) SIGMAR1EPHX1EPHX2SMN1; SMN2
SCHEMBL7611083 0.79 ALDH1A1 (0.46) KDM4ESIGMAR1EPHX1EPHX2ANPEP
SCHEMBL9407491 0.79 KDM4E (0.60) KDM4EEPHX1ANPEPERAP2HTT

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
EP-1265844-A1 METHOD FOR PRODUCING AMINES BY THE HYDROAMINOMETHYLATION OF OLEFINS IN THE PRESENCE OF IONIC LIQUIDS Bayer Aktiengesellschaft (DE) 2002-12-18 EP disclosed
WO-2001064621-A1 METHOD FOR PRODUCING AMINES BY THE HYDROAMINOMETHYLATION OF OLEFINS IN THE PRESENCE OF IONIC LIQUIDS BAYER AKTIENGESELLSCHAFT (DE) 2001-09-07 WO disclosed