SCHEMBL3421064

SCHEMBL3421064

CC(C)(C)Oc1ccc(Oc2ccc(O)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 3/20 0.64
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
ESR1 P03372 2/20 0.64
LTA4H P09960 6/20 0.58
KDM4E B2RXH2 1/20 0.57
NR1H2 P55055 1/20 0.54
BAX Q07812 1/20 0.54
ELANE P08246 1/20 0.47
PARP10 Q53GL7 1/20 0.45
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TYR P14679 1/20 0.41
CYP3A4 P08684 1/20 0.41
AR P10275 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
HTR6 P50406 1/20 0.41

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
SCHEMBL57369 0.93 MEN1 (0.57) ESR2MEN1KMT2AESR1LTA4H
Hydroquinone SCHEMBL28076396 0.93 MEN1 (0.57) ESR2MEN1KMT2AESR1LTA4H
SCHEMBL19339945 0.88 MAPT (0.44) ESR2MEN1KMT2AESR1LTA4H
SCHEMBL18866585 0.88 MAPT (0.44) ESR2MEN1KMT2AESR1LTA4H
SCHEMBL19491810 0.86 ESR2 (0.58) ESR2MEN1KMT2AESR1LTA4H
SCHEMBL3417993 0.86 ESR2 (0.58) ESR2MEN1KMT2AESR1LTA4H
Mequinol SCHEMBL28327417 0.84 LTA4H (0.61) ESR2MEN1KMT2ALTA4HKDM4E
Catechol SCHEMBL27850850 0.83 KDM4E (0.48) ESR2MEN1KMT2AESR1LTA4H
SCHEMBL12204980 0.83 ESR2 (0.67) ESR2MEN1KMT2AESR1LTA4H
Phenol SCHEMBL28106741 0.82 CA12 (0.50) ESR2MEN1KMT2AESR1LTA4H

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-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
US-4770989-A USING A THERMAL SOLVENT AND GELATIN/POLYVINYPYRROLIDONE POLYMER MIXTURE; DIFFUSION TRANSFER QUALITY IMAGE KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1988-09-13 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 ESR2 3003/4885MEN1 1868/4885KMT2A 539/4885

“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.