SCHEMBL9640875

SCHEMBL9640875

CCCN(CCC)CCCN(CC(C)O)CC(C)O

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
KCNA5 P22460 1/20 0.33
KDM4E B2RXH2 2/20 0.32
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30
MAPK1 P28482 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL9640734 0.91 KDM4E (0.37) TSHRKDM4EKMT2AMAPK1TDP1
SCHEMBL9640527 0.91 TSHR (0.36) TSHRKCNA5KDM4EKMT2AATM
SCHEMBL98701 0.91 TSHR (0.40) TSHRKCNA5KDM4EKMT2AATM
SCHEMBL9640755 0.89 DNM1 (0.36) KDM4EMAPK1TDP1
SCHEMBL436610 0.88 KDM4E (0.36) TSHRKDM4EKMT2AATMTDP1
SCHEMBL9641282 0.87 DNM1 (0.39)
SCHEMBL9641784 0.87 DNM1 (0.39)
SCHEMBL9641806 0.87 DNM1 (0.39)
SCHEMBL10989513 0.87 DNM1 (0.39)
SCHEMBL9640548 0.87 DNM1 (0.39)

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-5128408-A Quaternized amino polyurethane- or polyurethaneurea-polysiloxanes treated with heparin TOYO BOSEKI KABUSHIKI KAISHA (JP) 1992-07-07 US disclosed