SCHEMBL10500484

SCHEMBL10500484

C/C=C(/Cl)OC(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.52
LMNA P02545 2/20 0.50
F2 P00734 1/20 0.50
DAO P14920 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
TDP1 Q9NUW8 4/20 0.44
ALDH1A1 P00352 4/20 0.44
HSD17B10 Q99714 1/20 0.44
TP53 P04637 1/20 0.42
PLA2G7 Q13093 1/20 0.42
KMT2A Q03164 5/20 0.41
MAPT P10636 3/20 0.41
SLC6A3 Q01959 2/20 0.41
MAPK1 P28482 1/20 0.41
HIF1A Q16665 1/20 0.41
POLB P06746 1/20 0.41
SLC6A2 P23975 1/20 0.41
MEN1 O00255 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL10500498 1.00 TSHR (0.52) TSHRLMNAF2DAONAPRT
SCHEMBL6551398 0.82 LMNA (0.47) TSHRLMNAF2TDP1ALDH1A1
SCHEMBL6551256 0.81 AKR1C1 (0.48) TSHRLMNAF2TDP1ALDH1A1
SCHEMBL10500142 0.81 AKR1C1 (0.48) TSHRLMNAF2TDP1ALDH1A1
SCHEMBL10099630 0.79 TSHR (0.56) TSHRLMNAF2DAONAPRT
SCHEMBL1151641 0.79 LMNA (0.58) TSHRLMNAF2DAONAPRT
SCHEMBL8508528 0.79 LMNA (0.58) TSHRLMNAF2DAONAPRT
Methyl Alcohol SCHEMBL19514313 0.78 TSHR (0.65) TSHRLMNAF2DAONAPRT
Ethane SCHEMBL27444853 0.78 TSHR (0.65) TSHRLMNAF2DAONAPRT
SCHEMBL52413 0.78 LMNA (0.70) TSHRLMNAF2DAONAPRT

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
US-4835312-A Production process of N-substituted amide compounds MITSUI CHEMICALS, INCORPORATED (JP) 1989-05-30 US disclosed