SCHEMBL3417210

SCHEMBL3417210

CC(C)(C)c1cc(C2(C)CC(C)(C)c3cc(C(C)(C)C)c(O)cc32)ccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
ALOX15 P16050 4/20 0.41
LMNA P02545 2/20 0.41
NR1I2 O75469 1/20 0.41
CYP2C9 P11712 1/20 0.41
MIF P14174 1/20 0.41
TYR P14679 1/20 0.41
HTT P42858 1/20 0.41
NFE2L2 Q16236 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
ATP2A2 P16615 1/20 0.39
ATP2A3 Q93084 1/20 0.39
ATM Q13315 1/20 0.35
ESRRA P11474 1/20 0.34
GAA P10253 1/20 0.33
HSP90AA1 P07900 5/20 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
SCHEMBL3414363 0.87 ALDH1A1 (0.40) ALDH1A1ALOX15LMNANR1I2CYP2C9
SCHEMBL18399468 0.85 HSP90AA1 (0.38) ALDH1A1ALOX15LMNANR1I2CYP2C9
SCHEMBL18400660 0.84 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL11160785 0.81 ALDH1A1 (0.54) ALDH1A1ALOX15LMNANR1I2CYP2C9
SCHEMBL7774056 0.80 MEN1 (0.40) ALDH1A1ALOX15HSD17B10CYP1A2GAA
SCHEMBL4464213 0.78 ALDH1A1 (0.50) ALDH1A1ALOX15LMNANR1I2CYP2C9
SCHEMBL29740749 0.78 ALDH1A1 (0.50) ALDH1A1ALOX15LMNANR1I2CYP2C9
SCHEMBL8815064 0.77 RXRA (0.39) ALDH1A1LMNATYRHSD17B10TSHR
SCHEMBL18399471 0.75 HSP90AA1 (0.33) ALDH1A1ALOX15LMNANR1I2CYP2C9
SCHEMBL11144426 0.75 ALOX15 (0.36) ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767739-B2 Cyanato group-containing cyclic phosphazene compound and method for producing the same FUSHIMI PHARMACEUTICAL CO., LTD. (JP) 2010-08-03 US disclosed
US-20090170983-A1 Cyanato Group-Containing Cyclic Phosphazene Compound and Method for Producing The Same FUSHIMI PHARMACEUTICAL CO., LTD. (JP) 2009-07-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090170983-A1 Cyanato Group-Containing Cyclic Phosphazene Compound and Method for Producing The Same CENPE, CPNE4, MCM3 ALDH1A1 4254/4885ALOX15 1791/4885LMNA 3559/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.