SCHEMBL10708240

SCHEMBL10708240

C=CCCC(C=Cc1ccccc1)OC

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
CYP3A4 P08684 1/20 0.37
TRPA1 O75762 2/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.36
STAT3 P40763 2/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
RELA Q04206 1/20 0.34
NFE2L2 Q16236 1/20 0.34
HTR2A P28223 1/20 0.34

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
SCHEMBL10708234 1.00 MEN1 (0.55) MEN1KMT2ACYP3A4TRPA1ALDH1A1
SCHEMBL30953546 0.78 MEN1 (0.63) MEN1KMT2ACYP3A4TRPA1RELA
SCHEMBL3814977 0.76 MEN1 (0.47) MEN1KMT2ATRPA1ALDH1A1TSHR
SCHEMBL9491145 0.72 MEN1 (0.65) MEN1KMT2ACYP3A4TRPA1LMNA
SCHEMBL6201960 0.71 MEN1 (0.55) MEN1KMT2AALDH1A1TSHRHTR2A
SCHEMBL6201963 0.71 MEN1 (0.55) MEN1KMT2AALDH1A1TSHRHTR2A
Styrene SCHEMBL27605817 0.70 ALDH1A1 (0.54) MEN1KMT2AALDH1A1TSHRMAPT
Styrene SCHEMBL27398876 0.70 ALDH1A1 (0.54) MEN1KMT2AALDH1A1TSHRMAPT
Hydrochloric Acid SCHEMBL7226976 0.70 MEN1 (0.54) MEN1KMT2AALDH1A1TSHRHTR2A
Hydrochloric Acid SCHEMBL7226971 0.70 MEN1 (0.54) MEN1KMT2AALDH1A1TSHRHTR2A

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-0287750-A2 Photoactive curcumin derivatives SHIPLEY COMPANY INC. (US) 1988-10-26 EP disclosed