SCHEMBL2944071

SCHEMBL2944071

CC1=Cc2ccc(C)cc2C1CC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.40
SRC P12931 1/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 3/20 0.35
ALOX15 P16050 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
FFAR4 Q5NUL3 2/20 0.33
TSHR P16473 1/20 0.33
HSD11B1 P28845 1/20 0.33
HSD11B2 P80365 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAPDH P04406 1/20 0.33
POLB P06746 1/20 0.33
HSPA1A P0DMV8 1/20 0.33
HPGD P15428 1/20 0.33
APEX1 P27695 1/20 0.33
PTPN7 P35236 1/20 0.33
BRCA1 P38398 1/20 0.33

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
SCHEMBL1452902 0.79 CHRNB2 (0.32)
SCHEMBL1452360 0.79 CHRNB2 (0.32)
SCHEMBL3863586 0.75 PTGDR2 (0.35) PTGDR2FFAR4
SCHEMBL18489608 0.72 HTT (0.30)
SCHEMBL31633619 0.70 TRPA1 (0.33) PTGDR2KMT2AALOX15ALDH1A1HSD17B10
SCHEMBL25876757 0.69 KDM4E (0.43) PTGDR2SRCMEN1KMT2AMAPT
SCHEMBL14484522 0.69 NQO2 (0.44) MEN1KMT2AMAPTPOLBEGFR
SCHEMBL11587254 0.68 EGFR (0.40) SRCMAPTALOX15SMN1; SMN2FFAR4
SCHEMBL11202111 0.68 KMT2A (0.42) SRCKMT2AMAPTALOX15SMN1; SMN2
SCHEMBL2935757 0.68 TSHR (0.37) PTGDR2KMT2ASMN1; SMN2TSHRPOLB

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-1756027-B1 PROCESS FOR PRODUCING INDENOL ESTERS OR ETHERS FIRMENICH & CIE (CH) 2010-09-22 EP claimed