SCHEMBL8876027

SCHEMBL8876027

CCOC(=O)C1CC(C)CN1C(=O)Cc1c(C)cc(C)cc1C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
KMT2A Q03164 6/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
CACNA1A O00555 1/20 0.34
CACNA2D1 P54289 1/20 0.34
CACNB1 Q02641 1/20 0.34
MEN1 O00255 4/20 0.34
MAPK1 P28482 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
VHL P40337 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PEPD P12955 1/20 0.33
TP53 P04637 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
SCHEMBL8876139 0.90 VHL (0.42) POLBKMT2AALDH1A1LMNACACNA1A
SCHEMBL8877540 0.89 POLB (0.38) POLBKMT2AALDH1A1LMNACACNA1A
SCHEMBL8876637 0.88 POLB (0.40) POLBKMT2AALDH1A1CACNA1ACACNA2D1
SCHEMBL8876386 0.88 CTSS (0.40) CTSSCTSKKMT2AALDH1A1LMNA
SCHEMBL8878158 0.87 POLB (0.36) POLBKMT2AALDH1A1LMNACACNA1A
SCHEMBL8875741 0.85 ALDH1A1 (0.38) POLBCTSSCTSKKMT2AALDH1A1
SCHEMBL8876253 0.83 KMT2A (0.38) POLBCTSSCTSKKMT2AALDH1A1
SCHEMBL8877372 0.82 KMT2A (0.34) POLBKMT2AALDH1A1LMNAMEN1
SCHEMBL8313957 0.81 ALDH1A1 (0.33) POLBKMT2AALDH1A1LMNAMEN1
SCHEMBL8877494 0.81 KMT2A (0.50) POLBCTSSCTSKKMT2AALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5693663-A PESTICIDES; HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-02 US disclosed
US-5585384-A 1-OXY-FUNCTIONAL GROUP-2-ALKYLARYL-3-OXO-PYRROLIZINES; INSECTICIDES; NEMATOCIDES; HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-12-17 US disclosed
US-5288874-A Insecticides, miticides BAYER AKTIENGESELLSCHAFT (DE) 1994-02-22 US disclosed