SCHEMBL8877115

SCHEMBL8877115

CCOC(=O)C1C(C)CC(C)N1C(=O)Cc1c(C)cccc1C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MEN1 O00255 2/20 0.39
KDM4E B2RXH2 6/20 0.38
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
GAA P10253 1/20 0.37
ALDH1A1 P00352 8/20 0.37
HSD17B10 Q99714 2/20 0.36
HPGD P15428 2/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.34
GLA P06280 1/20 0.34
MAPT P10636 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL8875882 0.88 KMT2A (0.50) KMT2ASMN1; SMN2MEN1KDM4EAPOBEC3A
SCHEMBL8874941 0.88 MEN1 (0.36) KMT2ASMN1; SMN2MEN1KDM4EAPOBEC3A
SCHEMBL8878145 0.82 KMT2A (0.41) KMT2ASMN1; SMN2MEN1KDM4EAPOBEC3A
SCHEMBL8317855 0.81 KMT2A (0.34) KMT2ASMN1; SMN2MEN1KDM4EAPOBEC3A
SCHEMBL8876430 0.81 KMT2A (0.38) KMT2ASMN1; SMN2MEN1KDM4EGAA
SCHEMBL8876261 0.81 KMT2A (0.42) KMT2ASMN1; SMN2MEN1KDM4EAPOBEC3A
SCHEMBL8876228 0.80 SMN1; SMN2 (0.39) KMT2ASMN1; SMN2MEN1KDM4EAPOBEC3A
SCHEMBL8879187 0.80 KMT2A (0.38) KMT2ASMN1; SMN2MEN1KDM4EAPOBEC3A
SCHEMBL8875077 0.79 KMT2A (0.42) KMT2ASMN1; SMN2MEN1KDM4EAPOBEC3A
SCHEMBL8874706 0.78 KMT2A (0.44) KMT2ASMN1; SMN2MEN1KDM4EAPOBEC3A

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