SCHEMBL9812477

SCHEMBL9812477

CCCCCC(CCCC)N=C=N

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.37
CA2 P00918 1/20 0.36
OPRM1 P35372 1/20 0.36
LMNA P02545 1/20 0.33
CA1 P00915 1/20 0.33
FDPS P14324 4/20 0.31
NFKB1 P19838 1/20 0.31
TSHR P16473 1/20 0.30
THRB P10828 1/20 0.30
GPR84 Q9NQS5 2/20 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
SCHEMBL2045857 0.95 LMNA (0.38) DNM1CA2OPRM1LMNAFDPS
SCHEMBL9812486 0.87 LMNA (0.35) DNM1CA2OPRM1LMNAFDPS
SCHEMBL4692042 0.78 TSHR (0.32) TSHR
SCHEMBL17787524 0.77 CA2 (0.41) DNM1CA2OPRM1LMNACA1
SCHEMBL27709456 0.77 MAPT (0.38) DNM1CA2LMNACA1FDPS
SCHEMBL961380 0.76 LMNA (0.41) DNM1CA2OPRM1LMNAFDPS
SCHEMBL28109817 0.76 CA2 (0.32) DNM1CA2FDPSTSHR
SCHEMBL28426610 0.76 CA2 (0.44) DNM1CA2LMNACA1FDPS
SCHEMBL13847959 0.74
SCHEMBL21722662 0.73 MAPT (0.42) DNM1CA2LMNACA1FDPS

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
EP-0416250-A2 N-acylurea and O-acylisourea derivatives of hyaluronic acid THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1991-03-13 EP claimed