SCHEMBL8874706

SCHEMBL8874706

CCOC(=O)C1C(C)CCN1C(=O)Cc1c(C)cccc1C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MEN1 O00255 3/20 0.44
ALDH1A1 P00352 7/20 0.42
GAA P10253 1/20 0.41
KDM4E B2RXH2 6/20 0.41
HSD17B10 Q99714 3/20 0.41
HPGD P15428 1/20 0.41
APOBEC3A P31941 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
POLB P06746 1/20 0.38
TSHR P16473 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL8876977 0.93 KMT2A (0.44) KMT2ASMN1; SMN2MEN1ALDH1A1GAA
SCHEMBL8877073 0.88 KMT2A (0.55) KMT2ASMN1; SMN2MEN1ALDH1A1GAA
SCHEMBL8875891 0.88 POLB (0.41) KMT2ASMN1; SMN2MEN1ALDH1A1GAA
SCHEMBL8875939 0.81 KMT2A (0.55) KMT2ASMN1; SMN2MEN1ALDH1A1GAA
SCHEMBL8983644 0.81 KMT2A (0.43) KMT2ASMN1; SMN2MEN1ALDH1A1GAA
SCHEMBL8317229 0.81 KMT2A (0.38) KMT2ASMN1; SMN2MEN1ALDH1A1GAA
SCHEMBL8878180 0.81 POLB (0.40) KMT2ASMN1; SMN2MEN1ALDH1A1GAA
SCHEMBL8875560 0.81 KMT2A (0.43) KMT2ASMN1; SMN2MEN1ALDH1A1GAA
SCHEMBL8876405 0.80 MDM2 (0.40) KMT2ASMN1; SMN2MEN1ALDH1A1GAA
SCHEMBL8877115 0.78 KMT2A (0.39) KMT2ASMN1; SMN2MEN1ALDH1A1GAA

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