SCHEMBL8875666

SCHEMBL8875666

CCOC(=O)C1CCCC(C)N1C(=O)Cc1c(Cl)cccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
MEN1 O00255 3/20 0.52
GAA P10253 1/20 0.51
ALDH1A1 P00352 8/20 0.49
KDM4E B2RXH2 5/20 0.49
TDP1 Q9NUW8 2/20 0.49
TSHR P16473 3/20 0.46
POLB P06746 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
GLA P06280 1/20 0.45
HPGD P15428 1/20 0.45
ATM Q13315 1/20 0.43
DRD1 P21728 1/20 0.41
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL8876904 0.93 KMT2A (0.54) KMT2ASMN1; SMN2MEN1GAAALDH1A1
SCHEMBL8875764 0.89 KMT2A (0.43) KMT2ASMN1; SMN2MEN1GAAALDH1A1
SCHEMBL8877500 0.88 ALDH1A1 (0.47) KMT2ASMN1; SMN2MEN1GAAALDH1A1
SCHEMBL8875755 0.84 KMT2A (0.52) KMT2ASMN1; SMN2MEN1GAAALDH1A1
SCHEMBL8879041 0.83 KMT2A (0.53) KMT2ASMN1; SMN2MEN1GAAALDH1A1
SCHEMBL8317246 0.82 KMT2A (0.45) KMT2ASMN1; SMN2MEN1GAAALDH1A1
SCHEMBL9443610 0.82 KMT2A (0.50) KMT2ASMN1; SMN2MEN1GAAALDH1A1
SCHEMBL8877101 0.81 ALDH1A1 (0.42) KMT2ASMN1; SMN2MEN1ALDH1A1KDM4E
SCHEMBL8876049 0.81 TSHR (0.48) KMT2ASMN1; SMN2ALDH1A1TSHRPOLB
SCHEMBL8876411 0.81 KMT2A (0.51) KMT2ASMN1; SMN2MEN1GAAALDH1A1

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