SCHEMBL7474033

SCHEMBL7474033

CC=C(C)Oc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.42
CA4 P22748 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
HSP90AA1 P07900 1/20 0.39
GAA P10253 1/20 0.39
LTA4H P09960 3/20 0.39
TSHR P16473 1/20 0.39
ATM Q13315 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
KMT2A Q03164 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CA5A P35218 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
CYP1A2 P05177 1/20 0.37
RAD51 Q06609 1/20 0.36
NR1H2 P55055 1/20 0.36

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
SCHEMBL10769497 0.87 LMNA (0.42) ELANEALDH1A1MAPTHSP90AA1GAA
SCHEMBL4404272 0.81 ELANE (0.39) ELANECA4ALDH1A1MAPTHSP90AA1
SCHEMBL4404275 0.81 ELANE (0.39) ELANECA4ALDH1A1MAPTHSP90AA1
SCHEMBL19891675 0.81 ELANE (0.36) ELANECA4ALDH1A1MAPTHSP90AA1
SCHEMBL9310266 0.79 ALDH1A1 (0.47) ELANECA4ALDH1A1MAPTTSHR
SCHEMBL14445373 0.78 LMNA (0.58) ALDH1A1MAPTGAATSHRL3MBTL1
SCHEMBL22817307 0.78 ELANE (0.37) ELANECA4ALDH1A1MAPTHSP90AA1
SCHEMBL11310269 0.78 ELANE (0.37) ELANECA4ALDH1A1MAPTHSP90AA1
SCHEMBL10532941 0.77 CA4 (0.43) ELANECA4ALDH1A1MAPTHSP90AA1
SCHEMBL10532951 0.77 CA4 (0.43) ELANECA4ALDH1A1MAPTHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1194417-A1 PHENOXY FLUOROPYRIMIDINES BAYER AG (DE) 2002-04-10 EP claimed
WO-2000078733-A1 PHENOXY FLUOROPYRIMIDINES BAYER AKTIENGESELLSCHAFT (DE) 2000-12-28 WO claimed
EP-1877369-B1 INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN AND APO-B SECRETION SURFACE LOGIX INC (US) 2013-07-10 EP disclosed
EP-1194417-A1 PHENOXY FLUOROPYRIMIDINES BAYER AG (DE) 2002-04-10 EP disclosed
WO-2000078733-A1 PHENOXY FLUOROPYRIMIDINES BAYER AKTIENGESELLSCHAFT (DE) 2000-12-28 WO disclosed