SCHEMBL9575010

SCHEMBL9575010

CCOC(=O)Oc1ccc(CBr)o1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 6/20 0.38
PLK1 P53350 1/20 0.38
CUL4A Q13619 3/20 0.37
KDM4E B2RXH2 5/20 0.35
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
SOAT1 P35610 1/20 0.35
TYMS P04818 1/20 0.35
POLB P06746 3/20 0.34
HSD17B10 Q99714 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MEN1 O00255 1/20 0.34
ALOX15 P16050 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
SCHEMBL9688433 0.80 POLB (0.48) KMT2AALDH1A1CUL4AKDM4EMAPT
SCHEMBL2181967 0.73 ALDH1A1 (0.57) KMT2AALDH1A1KDM4EMAPTNPC1
SCHEMBL6972860 0.71 HTT (0.40) KMT2AALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL2486696 0.69 CUL4A (0.47) KMT2AALDH1A1CUL4AKDM4EMAPT
SCHEMBL10973674 0.68 MMP1 (0.44) KMT2AALDH1A1KDM4EMAPTNPC1
SCHEMBL6968831 0.67 KMT2A (0.41) KMT2AALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL363895 0.67 ALDH1A1 (0.40) KMT2AALDH1A1CUL4AMAPTNPC1
SCHEMBL6451238 0.67 ALDH1A1 (0.55) KMT2AALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL2323034 0.66 ALDH1A1 (0.50) KMT2AALDH1A1CUL4ANPC1RAB9A
SCHEMBL2484716 0.66 CUL4A (0.41) KMT2AALDH1A1CUL4AKDM4EMAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0563705-A2 Cycloalkyl- and heterocyclyl substituted imidazolylpropenic acid derivatives BAYER AG (DE) 1993-10-06 EP disclosed