SCHEMBL11501583

SCHEMBL11501583

CN(CCCNC(N)=NC(=O)NC12CC3CC(CC(C3)C1)C2)CCCNC(N)=NC(=O)NC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 20/20 0.47
▸ HTT P42858 1/20 0.47

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
SCHEMBL11573440 0.77 CACNA1H (0.52) EPHX2
SCHEMBL4017279 0.72 EPHX2 (0.66) EPHX2HTT
SCHEMBL11501703 0.70 DNM1 (0.44) —
SCHEMBL11501582 0.69 KMT2A (0.41) EPHX2HTT
SCHEMBL11501681 0.68 CHEK1 (0.34) —
SCHEMBL4016038 0.66 EPHX2 (0.71) EPHX2
SCHEMBL11501930 0.65 TMEM97 (0.46) HTT
SCHEMBL11501586 0.65 DNM1 (0.36) —
SCHEMBL25816688 0.65 LMNA (0.40) —
SCHEMBL7763881 0.64 CHEK1 (0.42) —

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
US-4166827-A DENTAL PLAQUE COOPER LABORATORIES, INC. (US) 1979-09-04 — — US claimed
US-4166827-A DENTAL PLAQUE COOPER LABORATORIES, INC. (US) 1979-09-04 — — US disclosed
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