SCHEMBL23901022

SCHEMBL23901022

CCC(C)CCCNC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
ACE2 Q9BYF1 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 1/20 0.37
EPHX1 P07099 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
USP2 O75604 1/20 0.35
TSHR P16473 1/20 0.35
BLM P54132 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
EPHX2 P34913 2/20 0.35
KDM4C Q9H3R0 1/20 0.33

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
SCHEMBL3664544 0.94 MEN1 (0.40) CYP2D6CYP2C19ACE2MEN1KMT2A
SCHEMBL6722031 0.87 CYP2D6 (0.44) CYP2D6CYP2C19ACE2SMN1; SMN2USP2
SCHEMBL4761459 0.83 KDM4E (0.54) MEN1KMT2AEPHX1USP2TSHR
SCHEMBL20836565 0.83 CYP2D6 (0.52) CYP2D6CYP2C19ACE2MEN1KMT2A
SCHEMBL14492895 0.83 KDM4E (0.54) MEN1KMT2AEPHX1USP2TSHR
SCHEMBL3874259 0.83 CYP2D6 (0.41) CYP2D6CYP2C19ACE2MEN1KMT2A
SCHEMBL13056218 0.82 DPP7 (0.38) ACE2MEN1KMT2AGAAEPHX1
SCHEMBL5208550 0.82 MEN1 (0.35) ACE2MEN1KMT2AGAAEPHX1
SCHEMBL23710264 0.82 DPP7 (0.38) ACE2MEN1KMT2AGAAEPHX1
SCHEMBL18829056 0.82 MEN1 (0.61) MEN1KMT2ASMN1; SMN2

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-20210309882-A1 COATING COMPOSITIONS HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2021-10-07 US disclosed