SCHEMBL9727384

SCHEMBL9727384

CCOC(=O)C1CCCCN1C(=O)Cc1c(F)cccc1Cl

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.67
SMN1; SMN2 Q16637 4/20 0.67
MEN1 O00255 3/20 0.67
GAA P10253 1/20 0.66
KDM4E B2RXH2 7/20 0.58
TSHR P16473 4/20 0.58
POLB P06746 1/20 0.58
ALDH1A1 P00352 8/20 0.57
TDP1 Q9NUW8 3/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
MAPT P10636 1/20 0.56
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
ALOX15 P16050 1/20 0.49
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
FKBP1A P62942 2/20 0.44
MAPK1 P28482 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL9727455 0.92 KMT2A (0.55) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL9727501 0.86 KMT2A (0.58) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL9727572 0.85 KMT2A (0.49) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL9534208 0.84 KMT2A (0.60) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL9727211 0.82 KDM4E (0.51) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL9727276 0.81 KMT2A (0.53) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL9724045 0.81 KMT2A (0.61) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL9727445 0.81 TSHR (0.55) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL9727245 0.79 FKBP1A (0.51) KMT2ASMN1; SMN2MEN1GAAKDM4E
SCHEMBL9727534 0.79 ALDH1A1 (0.54) KMT2ASMN1; SMN2MEN1GAAKDM4E

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-5142065-A Intermediates for herbicides, fungicides, miticides and insecticides BAYER AKTIENGESELLSCHAFT (DE) 1992-08-25 US disclosed
US-5091537-A Acylamino acid ester derivatives; insecticide, fungicide, herbicide, acaricide, and antimycotic agent BAYER AKTIENGESELLSCHAFT (DE) 1992-02-25 US disclosed
US-4985063-A INSECTICIDES, MITICIDES, HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1991-01-15 US disclosed