SCHEMBL19442919

SCHEMBL19442919

CC(C)(C1CCC(c2ccc(OCC3CO3)cc2)(c2ccc(OCC3CO3)cc2)CC1)C1CCC(c2ccc(OCC3CO3)cc2)(c2ccc(OC3CCO3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.47
▸ MAPT P10636 4/20 0.47
▸ TP53 P04637 3/20 0.47
▸ TSHR P16473 3/20 0.47
▸ HPGD P15428 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ HIF1A Q16665 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ PPARG P37231 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.40
▸ PKM P14618 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ SMN1; SMN2 Q16637 5/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ APP P05067 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ RAB9A P51151 5/20 0.32
▸ NPC1 O15118 4/20 0.32

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
SCHEMBL15934080 0.92 ALDH1A1 (0.55) ALDH1A1MAPTTP53TSHRHPGD
SCHEMBL19442962 0.88 ALDH1A1 (0.45) ALDH1A1MAPTTP53TSHRHPGD
SCHEMBL16691930 0.88 ALDH1A1 (0.51) ALDH1A1MAPTTP53TSHRHPGD
SCHEMBL15750165 0.87 ALDH1A1 (0.50) ALDH1A1MAPTTP53TSHRHPGD
SCHEMBL17359426 0.84 ALDH1A1 (0.47) ALDH1A1MAPTTP53TSHRHPGD
SCHEMBL17319675 0.84 ALDH1A1 (0.47) ALDH1A1MAPTTP53TSHRHPGD
SCHEMBL15869206 0.81 HSD11B1 (0.38) MEN1KMT2ARAB9ANPC1
SCHEMBL23448997 0.78 ALDH1A1 (0.64) ALDH1A1MAPTTP53TSHRHPGD
SCHEMBL22569477 0.78 ALDH1A1 (0.78) ALDH1A1MAPTTP53TSHRHPGD
SCHEMBL20869688 0.78 ALDH1A1 (0.64) ALDH1A1MAPTTP53TSHRHPGD

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
US-20170309844-A1 SUBSTRATE FOR DISPLAY, COLOR FILTER USING THE SAME AND METHOD FOR THE PRODUCTION THEREOF, ORGANIC EL ELEMENT AND METHOD FOR THE PRODUCTION THEREOF, AND FLEXIBLE ORGANIC EL DISPLAY (AS AMENDED) TORAY INDUSTRIES, INC. (JP) 2017-10-26 — — US disclosed
EP-2853386-B1 SUBSTRATE AND TOUCH PANEL MEMBER USING SAME TORAY INDUSTRIES (JP) 2017-10-25 — — EP disclosed
US-9788420-B2 Substrate and touch panel member using same TORAY INDUSTRIES, INC. (JP) 2017-10-10 — — US disclosed
Send feedback