SCHEMBL10697747

SCHEMBL10697747

CCOC(=O)/C(F)=C\c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.72
KMT2A Q03164 5/20 0.72
MAPT P10636 7/20 0.57
LMNA P02545 4/20 0.57
NPSR1 Q6W5P4 2/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
NR1H4 Q96RI1 1/20 0.54
S1PR4 O95977 1/20 0.53
S1PR1 P21453 1/20 0.53
MAPK1 P28482 1/20 0.53
POLB P06746 2/20 0.49
PLIN1 O60240 1/20 0.49
PLIN5 Q00G26 1/20 0.49
ABHD5 Q8WTS1 1/20 0.49
BACE1 P56817 1/20 0.47
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 3/20 0.47
HSP90AA1 P07900 1/20 0.47

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
SCHEMBL11309469 1.00 MEN1 (0.72) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL11309467 1.00 MEN1 (0.72) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL7070799 0.91 MEN1 (0.59) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL7070797 0.91 MEN1 (0.59) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL141618 0.88 MEN1 (0.56) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL9284038 0.87 MEN1 (0.56) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL14705767 0.85 MAPT (0.55) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL1541971 0.84 MEN1 (0.51) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL1788091 0.84 MEN1 (0.51) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL935186 0.84 MEN1 (1.00) MEN1KMT2AMAPTLMNANPSR1

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-0266725-A1 4-cyano-4-(fluorophenyl)-3-(substituted phenyl) butyric acids, esters and derivatives thereof, and a method of selectively controlling undesirable vegetation in rice therewith AMERICAN CYANAMID COMPANY (US) 1988-05-11 EP disclosed