SCHEMBL9723571

SCHEMBL9723571

CCN(CC)C(=O)N(C(N)=O)c1c(C(C)C)cccc1C(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.40
HSP90AB1 P08238 2/20 0.40
LMNA P02545 2/20 0.39
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38
SCN10A Q9Y5Y9 1/20 0.38
GABRA1 P14867 2/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
HPGD P15428 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
FAAH O00519 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
GABRB1 P18505 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36

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
Diethylamine SCHEMBL9723512 0.93 HSP90AA1 (0.36) HSP90AA1HSP90AB1LMNASCN5ASCN9A
SCHEMBL9723459 0.85 GRIN2D (0.39)
SCHEMBL9723422 0.82 LMNA (0.45) HSP90AA1LMNATDP1
SCHEMBL9723569 0.79
SCHEMBL9723545 0.77 NPSR1 (0.47) LMNAGABRA1GABRG2GABRB3HPGD
SCHEMBL9723469 0.76 LMNA (0.40) LMNA
SCHEMBL9723522 0.74 KMT2A (0.49) LMNASMN1; SMN2TDP1NLRP3
SCHEMBL19368005 0.72 GABRA1 (0.46) LMNAGABRA1GABRG2GABRB3SMN1; SMN2
SCHEMBL9723449 0.72 KMT2A (0.43) SMN1; SMN2CYP1A2TSHRALOX5
Diphenylamine SCHEMBL9723489 0.71 NPSR1 (0.40) LMNAHPGDCA1CA2CYP3A4

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-5153223-A Anticholesterol agents WARNER-LAMBERT COMPANY (US) 1992-10-06 US claimed