SCHEMBL7041252

SCHEMBL7041252

CC(C)(C)c1ccc(C(F)C(=O)c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MAPT P10636 1/20 0.49
ACHE P22303 1/20 0.49
ALDH1A1 P00352 2/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PTPN1 P18031 1/20 0.47
KCNK9 Q9NPC2 1/20 0.45
RAB9A P51151 3/20 0.44
ESRRG P62508 2/20 0.44
NR1H4 Q96RI1 2/20 0.44
NPC1 O15118 2/20 0.44
RECQL P46063 1/20 0.44
SRD5A2 P31213 1/20 0.43
TNF P01375 1/20 0.43
KLF5 Q13887 1/20 0.43
NOD1 Q9Y239 1/20 0.43
LMNA P02545 3/20 0.43
CES2 O00748 1/20 0.42

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
SCHEMBL4483081 0.82 TDP1 (0.61) TDP1L3MBTL1ALDH1A1TSHRPTPN1
SCHEMBL6512247 0.81 NR1H4 (0.54) TDP1L3MBTL1MAPTACHEALDH1A1
SCHEMBL6758776 0.81 ALDH1A1 (0.68) TDP1L3MBTL1MAPTACHEALDH1A1
SCHEMBL28403042 0.81 CES2 (0.52) TDP1L3MBTL1MAPTALDH1A1RAB9A
SCHEMBL30434916 0.79 LMNA (0.50) TDP1L3MBTL1ALDH1A1PTPN1KCNK9
SCHEMBL7930303 0.78 KMT2A (0.55) TDP1L3MBTL1MAPTALDH1A1TSHR
SCHEMBL5481259 0.78 TDP1 (0.46) TDP1L3MBTL1MAPTALDH1A1TSHR
SCHEMBL29110252 0.75 APAF1 (0.50) TDP1L3MBTL1MAPTALDH1A1TSHR
SCHEMBL4331474 0.75 ALDH1A1 (0.68) TDP1L3MBTL1MAPTALDH1A1TSHR
SCHEMBL10614602 0.74 MAPT (0.43) TDP1L3MBTL1MAPTALDH1A1TSHR

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
WO-2004028252-A1 PESTICIDAL COMPOSITION AND METHOD FOR CONTROLLING PEST ISHIHARA SANGYO KAISHA, LTD. (JP) 2004-04-08 WO claimed