SCHEMBL9700215

SCHEMBL9700215

Cc1cccc(F)c1C(=O)OC(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
KMT2A Q03164 5/20 0.42
LMNA P02545 3/20 0.41
F2 P00734 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
POLB P06746 2/20 0.40
HPGD P15428 1/20 0.40
IL2 P60568 1/20 0.40
ACHE P22303 1/20 0.39
PLA2G7 Q13093 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL9700205 0.90 CES2 (0.50) KMT2ALMNACES2CES1IL2
SCHEMBL6113405 0.88 TSHR (0.50) TSHRKMT2ALMNAF2POLB
SCHEMBL9701363 0.88 CES1 (0.48) TSHRKMT2ALMNAF2CES2
SCHEMBL28272899 0.81 CES2 (0.48) KMT2ALMNACES2CES1POLB
SCHEMBL18209597 0.81 TSHR (0.43) TSHRKMT2ALMNAF2POLB
SCHEMBL19875737 0.80 TSHR (0.48) TSHRKMT2ALMNAF2POLB
SCHEMBL19875734 0.80 TSHR (0.48) TSHRKMT2ALMNAF2POLB
SCHEMBL26657526 0.78 RORC (0.41) TSHRLMNAF2CES2CES1
SCHEMBL8056782 0.78 CA12 (0.53) KMT2ACES2CES1POLBIL2
SCHEMBL30632216 0.78 CA12 (0.53) KMT2ACES2CES1POLBIL2

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-0507576-A1 Polypropylene-based resin compositions TOSOH CORPORATION (JP) 1992-10-07 EP disclosed