SCHEMBL8876152

SCHEMBL8876152

CCOC(=O)C1CCC(C)CN1C(=O)Cc1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GAA P10253 2/20 0.39
TSHR P16473 3/20 0.39
MAPK1 P28482 1/20 0.39
RECQL P46063 1/20 0.39
ALDH1A1 P00352 4/20 0.38
POLB P06746 1/20 0.38
KDM4E B2RXH2 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
MAPT P10636 1/20 0.36
P2RX7 Q99572 1/20 0.35
DPP4 P27487 1/20 0.35

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
SCHEMBL8876253 0.90 KMT2A (0.38) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL8876156 0.89 KMT2A (0.52) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL8876826 0.86 TSHR (0.46) KMT2AMEN1SMN1; SMN2TSHRMAPK1
SCHEMBL8877540 0.84 POLB (0.38) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL8874911 0.83 KMT2A (0.41) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL8983664 0.83 VHL (0.40) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL9727276 0.83 KMT2A (0.53) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL8317349 0.82 GAA (0.35) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL8878241 0.82 KMT2A (0.38) KMT2AMEN1SMN1; SMN2GAATSHR
SCHEMBL8875827 0.81 KMT2A (0.41) KMT2AMEN1SMN1; SMN2GAAALDH1A1

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