SCHEMBL11067906

SCHEMBL11067906

CCOC(=O)C(C)c1ccccc1CC=C(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PIN1 Q13526 1/20 0.38
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 3/20 0.37
NPC1 O15118 1/20 0.37
BTN3A1 O00481 4/20 0.37
HTT P42858 2/20 0.37
NLRP3 Q96P20 1/20 0.36
KDM4E B2RXH2 1/20 0.36
APAF1 O14727 1/20 0.36
TDP2 O95551 1/20 0.36
NSD2 O96028 1/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CYP2D6 P10635 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
SCHEMBL11102355 0.87 KDM4E (0.41) SMN1; SMN2KMT2AALDH1A1MEN1BTN3A1
SCHEMBL28008699 0.83 TSHR (0.46) TSHRLMNASMN1; SMN2PIN1KMT2A
SCHEMBL11066693 0.82 PTGS2 (0.42) LMNASMN1; SMN2KMT2AALDH1A1HPGD
SCHEMBL7628102 0.80 TSHR (0.43) TSHRLMNASMN1; SMN2PIN1KMT2A
SCHEMBL7625054 0.79 TSHR (0.43) TSHRLMNASMN1; SMN2PIN1KMT2A
SCHEMBL15253448 0.79 TSHR (0.43) TSHRLMNASMN1; SMN2PIN1KMT2A
SCHEMBL28008700 0.77 CYSLTR2 (0.47) TSHRLMNASMN1; SMN2PIN1KMT2A
SCHEMBL363983 0.76 TSHR (0.48) TSHRLMNASMN1; SMN2PIN1KMT2A
SCHEMBL28008252 0.75 NLRP3 (0.50) TSHRLMNASMN1; SMN2PIN1KMT2A
SCHEMBL27081480 0.74 XPO1 (0.40) SMN1; SMN2KMT2AALDH1A1HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0074008-B1 PROCESS FOR PRODUCING ALPHA-ARYLALKANOIC ACID ESTERS TAISHO PHARMACEUTICAL CO. LTD (JP) 1984-10-10 EP disclosed
US-4433160-A Process for producing α-arylalkanoic acid ester TAISHO PHARMACEUTICAL COMPANY, LTD. (JP) 1984-02-21 US disclosed
EP-0074008-A2 Process for producing alpha-arylalkanoic acid esters TAISHO PHARMACEUTICAL CO. LTD (JP) 1983-03-16 EP disclosed