SCHEMBL6154824

SCHEMBL6154824

C=CCn1cc(C(=O)OC)c(C)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
KDM4E B2RXH2 2/20 0.40
POLB P06746 2/20 0.40
MAPT P10636 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HPGD P15428 2/20 0.36
TSHR P16473 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GRK6 P43250 1/20 0.36
NR4A2 P43354 1/20 0.35
NAMPT P43490 1/20 0.35
ALOX15 P16050 1/20 0.35
ALPL P05186 1/20 0.35
ALPI P09923 1/20 0.35
ALPG P10696 1/20 0.35
GAA P10253 1/20 0.34
LMNA P02545 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
SCHEMBL10666295 0.83 KDM4E (0.40) ALDH1A1KDM4EL3MBTL1HPGDTSHR
SCHEMBL3063888 0.81 ALPL (0.36) ALDH1A1KDM4EPOLBMAPTL3MBTL1
Hydrochloric Acid SCHEMBL10669237 0.81 KDM4E (0.39) ALDH1A1KDM4EL3MBTL1HPGDTSHR
SCHEMBL841237 0.81 ALDH1A1 (0.51) ALDH1A1KDM4EPOLBMAPTTDP1
SCHEMBL6156337 0.77 ALDH1A1 (0.43) ALDH1A1KDM4EPOLBMAPTTDP1
SCHEMBL841632 0.75 GAA (0.51) ALDH1A1KDM4EPOLBMAPTNR4A2
SCHEMBL21723868 0.74 KMT2A (0.43) ALDH1A1KDM4EPOLBL3MBTL1HPGD
SCHEMBL720425 0.74 KLKB1 (0.53) ALDH1A1POLBMAPTTDP1L3MBTL1
SCHEMBL21723813 0.73 KMT2A (0.38) ALDH1A1KDM4EPOLBMAPTTDP1
SCHEMBL11333507 0.72 HTT (0.35) ALDH1A1KDM4EMAPTTDP1L3MBTL1

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-1580189-A1 4-AMINO-5-METHYLPYRAZOLE DERIVATIVES AND PROCESS FOR PRODUCTION THEREOF Sankyo Agro Company, Limited (JP) 2005-09-28 EP disclosed